4,5,6,7-Tetrahydro-5α-methyl-6-(3-methyl-2-butenyl)-8-chloroimidazo[4,5,1-jk][1,4]benzodiazepine-2(1H)-thione

• 常用名: 4,5,6,7-Tetrahydro-5α-methyl-6-(3-methyl-2-butenyl)-8-chloroimidazo[4,5,1-jk][1,4]benzodiazepine-2(1H)-thione
• 英文名: 4,5,6,7-Tetrahydro-5α-methyl-6-(3-methyl-2-butenyl)-8-chloroimidazo[4,5,1-jk][1,4]benzodiazepine-2(1H)-thione
• CAS号: 137332-54-8
• 分子量: 320.88000
• 密度: 1.25g/cm3
• 沸点: 446.1ºC at 760 mmHg
• 分子式: C₁₇H₂₁ClN₂S
• 熔点: N/A
• 闪点: 223.6ºC

名称

• 英文名: Tivirapine

物理化学性质

• 密度: 1.25g/cm3
• 沸点: 446.1ºC at 760 mmHg
• 分子式: C₁₇H₂₁ClN₂S
• 分子量: 320.88000
• 闪点: 223.6ºC
• 精确质量: 320.11100
• PSA: 56.62000
• LogP: 5.14310
• InChIKey: ZNFFMCYSMBXZQU-NSHDSACASA-N
• SMILES: CC(C)=CCN1Cc2c(Cl)ccc3[nH]c(=S)n(c23)CC1C
• 蒸汽压: 3.73E-08mmHg at 25°C
• 折射率: 1.642

靶点实验

查看更多实验

实验名称：Antiviral activity against Human immunodeficiency virus 1 infected in human MT4 cells 来源：ChEMBL 靶标：Human immunodeficiency virus 1 External Id：CHEMBL1047741

实验名称：Experimentally measured binding affinity data (IC50) for protein-ligand complexes der... 来源：Shanghai Institute of Organic Chemistry 靶标：N/A External Id：PDBbind-IC50 for protein-ligand complexes

实验名称：HIV Enzyme Data 来源：NIAID 靶标：N/A External Id：HIV Enzyme Data

实验名称：Inhibition of HIV reverse transcriptase 来源：ChEMBL 靶标：N/A External Id：CHEMBL1103684

实验名称：HIV Cellular Data 来源：NIAID 靶标：N/A External Id：HIV Cellular Data

实验名称：Selectivity index was determined in C8166 cells 来源：ChEMBL 靶标：N/A External Id：CHEMBL841171

实验名称：Inhibition of HIV-1 reverse transcriptase. 来源：ChEMBL 靶标：Reverse transcriptase/RNaseH External Id：CHEMBL797513

实验名称：Concentration which produces a 50% survival of HIV-1 infected cells relative to uninf... 来源：ChEMBL 靶标：Human immunodeficiency virus 1 External Id：CHEMBL656739

实验名称：Concentration required to inhibit 50% viral production of human immunodeficiency viru... 来源：ChEMBL 靶标：Human immunodeficiency virus 1 External Id：CHEMBL833971

实验名称：Antiviral activity against HIV1 infected in human MT4 cells assessed as protection ag... 来源：ChEMBL 靶标：Human immunodeficiency virus 1 External Id：CHEMBL1109941

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英文别名

• 8-Chloro-TIBO
• 5-CHLORO-8-METHYL-7-(3-METHYL-BUT-2-ENYL)-6,7,8,9-TETRAHYDRO-2H-2,7,9A-TRIAZA-BENZO[CD]AZULENE-1-THIONE
• 8-ClTIBO
• 1uwb
• (+)-(S)-8-chloro-4,5,6,7-tetrahydro-5-methyl-6-(3-methyl-2-butenyl)imidazo[4,5,1-jk][1,4]benzodiazepine-2(1H)-thione
• (+)-(S)-4,5,6,7-Tetrahydro-8-chloro-5-methyl-6-(3-methyl-2-butenyl)imidazo<4,5,1-jk><1,4>benzodiazepine-2(1H)-thione