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Lidoflazine structure, CAS 3416-26-0

Lidoflazine

CAS Number3416-26-0

Synonyms4-[4,4-Bis(4-fluorophenyl)butyl]-N-(2,6-dimethylphenyl)-1-piperazineacetamide; 2-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide

Molecular FormulaC30H35F2N3O

Molecular Weight491.62

Purity≥98 (HPLC)%

Density1.161g/cm3

Boiling Point632.6ºC at 760mmHg

Melting Point158-162ºC

Flash Point

Appearancepowder

EINECS222-312-8

MSDSChineseEnglish

SymbolTransport

Signal WordWarning

Cat. No.: 2A-9011179 Purity: ≥98 (HPLC)%
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Quality Control of [ 3416-26-0 ] Purity: ≥98 (HPLC)% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number3416-26-0
Catalog No.2A-9011179
Chinese Name利多氟嗪
Synonyms4-[4,4-Bis(4-fluorophenyl)butyl]-N-(2,6-dimethylphenyl)-1-piperazineacetamide; 2-[4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide
Molecular FormulaC30H35F2N3O
Molecular Weight491.62
Purity≥98 (HPLC)
Density1.161g/cm3
Boiling Point632.6ºC at 760mmHg
Melting Point158-162ºC
Appearancepowder
Water SolubilityDMSO: ≥10mg/mL
Storage Condition2-8°C
ApplicationLidoflazine is a high-affinity blocker of HERG K+ channels. Lidoflazine is also an antianginal calcium channel blocker and carries a significant risk of prolongation of the QT interval and development
EINECS222-312-8
PubChem ID329817673
MDL NumberMFCD00057353
SMILESCc1cccc(C)c1NC(=O)CN2CCN(CCCC(c3ccc(F)cc3)c4ccc(F)cc4)CC2
InChI1S/C30H35F2N3O/c1-22-5-3-6-23(2)30(22)33-29(36)21-35-19-17-34(18-20-35)16-4-7-28(24-8-12-26(31)13-9-24)25-10-14-27(32)15-11-25/h3,5-6,8-15,28H,4,7,16-21H2,1-2H3,(H,33,36)
InChI KeyZBIAKUMOEKILTF-UHFFFAOYSA-N
NACRES CodeNA.77
UNSPSC12352200
Hazard SymbolsTransport
MSDSmsds/11179_1_3416_26_0.pdf
BioactivityLidoflazine is a high affinity blocker of the HERG (human ether-a-go-go-related gene) K+ channel. Lidoflazine is an antianginal calcium channel blocker that carries a significant risk of QT interval prolongation and ventricular arrhythmia[1]. Target Ca2+ In Vitro Lidoflazine inhibits potently HERG current (IHERG) recorded from HEK 293 cells stably expressing wild-type HERG (IC50 of ~16 nM). References [1]. https://www.ncbi.nlm.nih.gov/pubmed/15135665 Chemical & Physical Properties Density 1.161g/cm3 Boiling Point 632.6ºC at 760mmHg Melting Point 158-162ºC Molecular Formula C30H35F2N3O Molecular Weight 491.61500 Flash Point 336.4ºC Exact Mass 491.27500 PSA 35.58000 LogP 5.69880 Appearance of Characters white Index of Refraction 1.581 InChIKey ZBIAKUMOEKILTF-UHFFFAOYSA-N SMILES Cc1cccc(C)c1NC(=O)CN1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 Storage condition 2-8°C Water Solubility DMSO: ≥10mg/mL
Use ofLidoflazine is a high affinity blocker of the HERG (human ether-a-go-go-related gene) K+ channel. Lidoflazine is an antianginal calcium channel blocker that carries a significant risk of QT interval prolongation and ventricular arrhythmia[1]. Properties Articles27 Name Lidoflazine Synonym More Synonyms Lidoflazine Biological Activity Description Lidoflazine is a high affinity blocker of the HERG (human ether-a-go-go-related gene) K+ channel. Lidoflazine is an antianginal calcium channel blocker that carries a significant risk of QT interval prolongation and ventricular arrhythmia[1]. References [1]. https://www.ncbi.nlm.nih.gov/pubmed/15135665 Chemical & Physical Properties Molecular Formula C30H35F2N3O Exact Mass 491.27500 PSA 35.58000 LogP 5.69880 Appearance of Characters white Index of Refraction 1.581 InChIKey ZBIAKUMOEKILTF-UHFFFAOYSA-N
Transport InfoShipping Name: UN
MSDS Transport InfoModule 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 United Nations shipping name 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 Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available
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