
CAS Number1300031-52-0
Synonyms4-((2S,4R)-1-acetyl-4-((4-chlorophenyl)amino)-2-methyl-1,2,3,4-tetrahydroquinolin-6-yl)benzoic acid; 4-((2S,4R)-1-acetyl-4-((4-chlorophenyl)amino)-2-methyl-1,2,3,4-tetrahydro-6-quinolinyl)benzoic acid; 4-{(2S,4R)-1-Acetyl-4-[(4-chlorophenyl)amino]-2-methyl-1,2,3,4-tetrahydro-6-quinolinyl}benzoic acid; GSK1324726A
Molecular FormulaC25H23O3N2Cl1
Molecular Weight434.92
Density1.3±0.1 g/cm3
Boiling Point707.3±60.0 °C at 760 mmHg
Appearancepowder
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 1300031-52-0 |
| Catalog No. | 2A-1195251 |
| Chinese Name | GSK1324726A |
| Synonyms | 4-((2S,4R)-1-acetyl-4-((4-chlorophenyl)amino)-2-methyl-1,2,3,4-tetrahydroquinolin-6-yl)benzoic acid; 4-((2S,4R)-1-acetyl-4-((4-chlorophenyl)amino)-2-methyl-1,2,3,4-tetrahydro-6-quinolinyl)benzoic acid; 4-{(2S,4R)-1-Acetyl-4-[(4-chlorophenyl)amino]-2-methyl-1,2,3,4-tetrahydro-6-quinolinyl}benzoic acid; GSK1324726A |
| Molecular Formula | C25H23O3N2Cl1 |
| Molecular Weight | 434.92 |
| Density | 1.3±0.1 g/cm3 |
| Boiling Point | 707.3±60.0 °C at 760 mmHg |
| Appearance | powder |
| Storage Condition | -20℃ |
| Application | GSK1324726A is a potent and selective BET protein inhibitor that binds with high affinity to BRD2 (IC50=41 nM), BRD3 (IC50=31 nM) and BRD4 (IC50=22 nM). |
| MDL Number | MFCD28144683 |
| SMILES | CC(=O)N1c2ccc(-c3ccc(C(=O)O)cc3)cc2C(Nc2ccc(Cl)cc2)CC1C |
| InChI | InChI=1S/C25H23ClN2O3/c1-15-13-23(27-21-10-8-20(26)9-11-21)22-14-19(7-12-24(22)28(15)16(2)29)17-3-5-18(6-4-17)25(30)31/h3-12,14-15,23,27H,13H2,1-2H3,(H,30,31)/t15-,23+/m0/s1 |
| InChI Key | FAWSUKOIROHXAP-NPMXOYFQSA-N |
| MSDS | msds/196937_1_1300031_52_0.pdf |
| Transport Info | Product name: GSK1324726A (I-BET726) |
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