|
|
| | 6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-6-acetic acid, 4-(4-chlorophenyl)-2,3,9-triMethyl-, (6S)- Basic information |
| Product Name: | 6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-6-acetic acid, 4-(4-chlorophenyl)-2,3,9-triMethyl-, (6S)- | | Synonyms: | 6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-6-acetic acid, 4-(4-chlorophenyl)-2,3,9-triMethyl-, (6S)-;(+)-JQ1 (free acid);(+)-JQ-1 CARBOXYLIC ACID; 6H-THIENO[3;2-F][1;2;4]TRIAZOLO[4;3-A][1;4]DIAZEPINE-6-ACETIC ACID; 4-(4-CHLOROPHENYL)-2;3;9-TRIMETHYL-; (6S)-;3-a][1;4-(4-chlorophenyl)-2;4]diazepine-6-acetic acid;6H-Thieno[3;9-trimethyl- | | CAS: | 202592-23-2 | | MF: | C19H17ClN4O2S | | MW: | 400.88 | | EINECS: | | | Product Categories: | | | Mol File: | 202592-23-2.mol | ![6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-6-acetic acid, 4-(4-chlorophenyl)-2,3,9-triMethyl-, (6S)- Structure](CAS/20150408/GIF/202592-23-2.gif) |
| | 6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-6-acetic acid, 4-(4-chlorophenyl)-2,3,9-triMethyl-, (6S)- Chemical Properties |
| Boiling point | 661.6±65.0 °C(Predicted) | | density | 1.51±0.1 g/cm3(Predicted) | | storage temp. | Sealed in dry,Store in freezer, under -20°C | | solubility | DMSO:43.92(Max Conc. mg/mL);109.56(Max Conc. mM) DMSO:PBS (pH 7.2) (1:4):0.2(Max Conc. mg/mL);0.5(Max Conc. mM) DMF:20.0(Max Conc. mg/mL);49.89(Max Conc. mM) Ethanol:27.55(Max Conc. mg/mL);68.72(Max Conc. mM) | | form | A crystalline solid | | pka | 4.11±0.10(Predicted) | | color | Off-white to yellow | | InChI | InChI=1S/C19H17ClN4O2S/c1-9-10(2)27-19-16(9)17(12-4-6-13(20)7-5-12)21-14(8-15(25)26)18-23-22-11(3)24(18)19/h4-7,14H,8H2,1-3H3,(H,25,26)/t14-/m0/s1 | | InChIKey | LJOSBOOJFIRCSO-AWEZNQCLSA-N | | SMILES | N12C(C)=NN=C1[C@H](CC(O)=O)N=C(C1=CC=C(Cl)C=C1)C1C(C)=C(C)SC=12 |
| | 6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-6-acetic acid, 4-(4-chlorophenyl)-2,3,9-triMethyl-, (6S)- Usage And Synthesis |
| Uses | (+)-JQ1 Carboxylic Acid is a selective inhibitor of BET bromodomains. | | storage | Store at -20°C |
| | 6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-6-acetic acid, 4-(4-chlorophenyl)-2,3,9-triMethyl-, (6S)- Preparation Products And Raw materials |
|