CAS Number13997-19-8
Synonyms7-(Benzyloxy)-6-n-butyl-1,4-dihydro-4-oxo-3-quinolinecarboxylic Acid Methyl Ester; 7-(Benzyloxy)-6-n-butyl-3-methoxycarbonyl-4-quinolone; nequinate; MFCD00867198; methyl 7-(benzyloxy)-6-butyl-4-oxo-1,4-dihydroquinoline-3-carboxylate; Methyl 7-(benzyloxy)-6-butyl-4-oxo-1,4-dihydro-3-quinolinecarboxylate; EINECS 237-796-6; 3-Quinolinecarboxylic acid, 6-butyl-1,4-dihydro-4-oxo-7-(phenylmethoxy)-, methyl ester; 7-(Benzyloxy)-6-n-butyl-4-hydroxy-3-quinolinecarboxylic Acid Methyl Ester; 3-Methoxycarbonyl-6-n-butyl-7-benzyloxy-4-oxoquinoline
Molecular FormulaC22H23NO4
Molecular Weight365.42
Purity99%
Density1.2±0.1 g/cm3
Boiling Point520.7±50.0 °C at 760 mmHg
Melting Point287.5ºC
AppearanceLight yellow, odorless powder
EINECS237-796-6
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 13997-19-8 |
| Catalog No. | 2A-9011616 |
| Chinese Name | 奈喹酯 |
| Synonyms | 7-(Benzyloxy)-6-n-butyl-1,4-dihydro-4-oxo-3-quinolinecarboxylic Acid Methyl Ester; 7-(Benzyloxy)-6-n-butyl-3-methoxycarbonyl-4-quinolone; nequinate; MFCD00867198; methyl 7-(benzyloxy)-6-butyl-4-oxo-1,4-dihydroquinoline-3-carboxylate; Methyl 7-(benzyloxy)-6-butyl-4-oxo-1,4-dihydro-3-quinolinecarboxylate; EINECS 237-796-6; 3-Quinolinecarboxylic acid, 6-butyl-1,4-dihydro-4-oxo-7-(phenylmethoxy)-, methyl ester; 7-(Benzyloxy)-6-n-butyl-4-hydroxy-3-quinolinecarboxylic Acid Methyl Ester; 3-Methoxycarbonyl-6-n-butyl-7-benzyloxy-4-oxoquinoline |
| Molecular Formula | C22H23NO4 |
| Molecular Weight | 365.42 |
| Purity | 99 |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 520.7±50.0 °C at 760 mmHg |
| Melting Point | 287.5ºC |
| Appearance | Light yellow, odorless powder |
| Storage Condition | Sealed and stored in a cool, dry warehouse. |
| Application | Nequinate is a quinoline compound, anticoccidial agent, against Eimeria tenella infection. Nequinate inhibits xanthine oxidoreductase (XOD) activity. |
| EINECS | 237-796-6 |
| HTC | 2933499090 |
| PubChem ID | 329754551 |
| MDL Number | MFCD00867198 |
| SMILES | CCCCc1cc2C(=O)C(=CNc2cc1OCc3ccccc3)C(=O)OC |
| InChI | 1S/C22H23NO4/c1-3-4-10-16-11-17-19(23-13-18(21(17)24)22(25)26-2)12-20(16)27-14-15-8-6-5-7-9-15/h5-9,11-13H,3-4,10,14H2,1-2H3,(H,23,24) |
| InChI Key | NNOPDLNHPOLRRE-UHFFFAOYSA-N |
| NACRES Code | NA.24 |
| UNSPSC | 41116107 |
| Hazard Symbols | Transport |
| MSDS | msds/11616_1_13997_19_8.pdf |
| Bioactivity | Nequinate, a quinoline compound, is an anticoccidial agent against cecal coccidiosis (Eimeria tenella) infections[1]. Nequinate inhibits xanthine oxidoreductase (XOD) activity[2]. Related Catalog Research Areas >> Infection Research Areas >> Metabolic Disease Signaling Pathways >> Metabolic Enzyme/Protease >> Xanthine Oxidase In Vitro Xanthine oxidase (XOD) is a successful and safe drug target for lowering lower serum urate (sUA) levels , it plays an important role in the catabolism of purine Nequinate shows an inhibition of 12.0% to inhibit XOD activities[2]. References [1]. D K McLoughlin, et al.Efficacy of Nequinate Against Thirteen Strains of Eimeria Tenella and the Development of a Nequinate-Resistant Strain.Avian Dis. Oct-Dec 1973;17(4):717-21. [2]. Yanfen Niu, et al. Old Drug, New Indication: Olsalazine Sodium Reduced Serum Uric Acid Levels in Mice via Inhibiting Xanthine Oxidoreductase Activity. J Pharmacol Sci. 2017 Nov;135(3):114-120. Chemical & Physical Properties Density 1.2±0.1 g/cm3 Boiling Point 520.7±50.0 °C at 760 mmHg Melting Point 287.5ºC Molecular Formula C22H23NO4 Molecular Weight 365.422 Flash Point 268.7±30.1 °C Exact Mass 365.162720 PSA 68.39000 LogP 6.01 Vapour Pressure 0.0±1.4 mmHg at 25°C Index of Refraction 1.579 InChIKey NNOPDLNHPOLRRE-UHFFFAOYSA-N SMILES CCCCc1cc2c(=O)c(C(=O)OC)c[nH]c2cc1OCc1ccccc1 |
| Use of | Nequinate, a quinoline compound, is an anticoccidial agent against cecal coccidiosis (Eimeria tenella) infections[1]. Nequinate inhibits xanthine oxidoreductase (XOD) activity[2]. Properties Articles10 Name Methyl 7-(benzyloxy)-6-butyl-4-oxo-1,4-dihydroquinoline-3-carboxylate Synonym More Synonyms Nequinate Biological Activity Description Nequinate, a quinoline compound, is an anticoccidial agent against cecal coccidiosis (Eimeria tenella) infections[1]. Nequinate inhibits xanthine oxidoreductase (XOD) activity[2]. Related Catalog Research Areas >> Infection Research Areas >> Metabolic Disease Signaling Pathways >> Metabolic Enzyme/Protease >> Xanthine Oxidase In Vitro Xanthine oxidase (XOD) is a successful and safe drug target for lowering lower serum urate (sUA) levels , it plays an important role in the catabolism of purine Nequinate shows an inhibition of 12.0% to inhibit XOD activities[2]. References [1]. D K McLoughlin, et al.Efficacy of Nequinate Against Thirteen Strains of Eimeria Tenella and the Development of a Nequinate-Resistant Strain.Avian Dis. Oct-Dec 1973;17(4):717-21. [2]. Yanfen Niu, et al. Old Drug, New Indication: Olsalazine Sodium Reduced Serum Uric Acid Levels in Mice via Inhibiting Xanthine Oxidoreductase Activity. J Pharmacol Sci. 2017 Nov;135(3):114-120. Chemical & Physical Properties Molecular Formula C22H23NO4 Exact Mass 365.162720 PSA 68.39000 Index of Refraction 1.579 InChIKey NNOPDLNHPOLRRE-UHFFFAOYSA-N |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: Purity: 98.0% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special reminder to users No data available |
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