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Home > Products > Pharmaceutical R&D Materials > Heterocyclic Building Blocks > 5-Amino-1-(3,5-dichloro-4-(4-chlorobenzoyl)benzyl)-1H-1,2,3-triazole-4-carboxamide
5-Amino-1-(3,5-dichloro-4-(4-chlorobenzoyl)benzyl)-1H-1,2,3-triazole-4-carboxamide structure, CAS 99519-84-3

5-Amino-1-(3,5-dichloro-4-(4-chlorobenzoyl)benzyl)-1H-1,2,3-triazole-4-carboxamide

CAS Number99519-84-3

Synonyms4-CAI; CAI; Carboxyamido-triazole; Carboxyamidotriazole

Molecular FormulaC17H12Cl3N5O2

Molecular Weight424.67

Purity≥98 (HPLC)%

Density1.65g/cm3

Boiling Point685.5ºC at 760 mmHg

Melting Point

Flash Point

Appearancepowder

EINECS

MSDSChineseEnglish

Symboltransportation

Signal WordWarning

Cat. No.: 2A-9049629 Purity: ≥98 (HPLC)%
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Quality Control of [ 99519-84-3 ] Purity: ≥98 (HPLC)% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number99519-84-3
Catalog No.2A-9049629
Chinese Name羧基酰胺
Synonyms4-CAI; CAI; Carboxyamido-triazole; Carboxyamidotriazole
Molecular FormulaC17H12Cl3N5O2
Molecular Weight424.67
Purity≥98 (HPLC)
Density1.65g/cm3
Boiling Point685.5ºC at 760 mmHg
Appearancepowder
Storage Condition2-8°C, sealed, dry
ApplicationCarboxyamidotriazole (L 651582; ​​CAI) is a voltage-independent calcium channel blocker and a non-cytotoxic antineoplastic agent with anti-inflammatory activity.
PubChem ID329825403
MDL NumberMFCD00866325
SMILESNC(=O)c1nnn(Cc2cc(Cl)c(c(Cl)c2)C(=O)c3ccc(Cl)cc3)c1N
InChI1S/C17H12Cl3N5O2/c18-10-3-1-9(2-4-10)15(26)13-11(19)5-8(6-12(13)20)7-25-16(21)14(17(22)27)23-24-25/h1-6H,7,21H2,(H2,22,27)
InChI KeyWNRZHQBJSXRYJK-UHFFFAOYSA-N
NACRES CodeNA.77
UNSPSC12352200
Hazard Symbolstransportation
MSDSmsds/49629_1_99519_84_3.pdf
BioactivityCarboxyamidotriazole (L 651582; CAI) is a blocker of non-voltage dependent calcium channel[1]. Carboxyamidotriazole (L 651582; CAI) is a non-cytotoxic anti-tumor drug, which also shows anti-inflammatory activity[2]. Related Catalog Signaling Pathways >> Membrane Transporter/Ion Channel >> Calcium Channel Research Areas >> Cancer Research Areas >> Inflammation/Immunology Target Calcium channel[1] References [1]. Chen C, et al. Carboxyamidotriazole Synergizes with Sorafenib to Combat Non-Small Cell Lung Cancer through Inhibition of NANOG and Aggravation of Apoptosis. J Pharmacol Exp Ther. 2017 Aug;362(2):219-229. [2]. Hussain MM, et al. J Clin Oncol. 2003 Dec 1;21(23):4356-63. Chemical & Physical Properties Density 1.65g/cm3 Boiling Point 685.5ºC at 760 mmHg Molecular Formula C17H12Cl3N5O2 Molecular Weight 424.67 Flash Point 368.3ºC Exact Mass 423.00600 PSA 116.89000 LogP 4.48020 Index of Refraction 1.73 InChIKey WNRZHQBJSXRYJK-UHFFFAOYSA-N SMILES NC(=O)c1nnn(Cc2cc(Cl)c(C(=O)c3ccc(Cl)cc3)c(Cl)c2)c1N
Use ofCarboxyamidotriazole (L 651582; CAI) is a blocker of non-voltage dependent calcium channel[1]. Carboxyamidotriazole (L 651582; CAI) is a non-cytotoxic anti-tumor drug, which also shows anti-inflammatory activity[2]. Properties Articles37 Name 5-amino-1-[[3,5-dichloro-4-(4-chlorobenzoyl)phenyl]methyl]triazole-4-carboxamide Synonym More Synonyms L-651,582 Biological Activity Description Carboxyamidotriazole (L 651582; CAI) is a blocker of non-voltage dependent calcium channel[1]. Carboxyamidotriazole (L 651582; CAI) is a non-cytotoxic anti-tumor drug, which also shows anti-inflammatory activity[2]. Related Catalog Signaling Pathways >> Membrane Transporter/Ion Channel >> Calcium Channel Research Areas >> Cancer Research Areas >> Inflammation/Immunology Calcium channel[1] References [1]. Chen C, et al. Carboxyamidotriazole Synergizes with Sorafenib to Combat Non-Small Cell Lung Cancer through Inhibition of NANOG and Aggravation of Apoptosis. J Pharmacol Exp Ther. 2017 Aug;362(2):219-229. [2]. Hussain MM, et al. J Clin Oncol. 2003 Dec 1;21(23):4356-63. Chemical & Physical Properties Exact Mass 423.00600 PSA 116.89000 LogP 4.48020 Index of Refraction 1.73 InChIKey WNRZHQBJSXRYJK-UHFFFAOYSA-N
Transport InfoProduct name: Purity: 98.0%
MSDS Transport InfoModule 14. Shipping information 14.1 UN dangerous goods number European Dangerous Regulations for land transport: 2811 International Dangerous Regulations for sea transport: 2811 International Dangerous Regulations for air transport: 2811 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: TOXIC SOLID, ORGANIC, N.O.S. (Carboxyamidotriazole) IMDG Code: TOXIC SOLID, ORGANIC, N.O.S. (Carboxyamidotriazole) IFRS: Toxic solid, organic, n.o.s. (Carboxyamidotriazole) 14.3 Transport hazard categories European Land Transport Danger Regulations: 6.1 International Maritime Transport Danger Regulations: 6.1 International Air Transport Danger Regulations: 6.1 14.4 Package group European Land Transport Danger Regulations: III International Maritime Transport Danger Regulations: III International Air Transport Danger Regulations: III 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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