3-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-4-(piperazin-1-yl)-N-(propan-2-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-4-(piperazin-1-yl)-N-(propan-2-yl)benzamide--trifluoroacetic acid (1/1)
3-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-4-(piperazin-1-yl)-N-(propan-2-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0778 |
| Compound Name: | 3-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}-4-(piperazin-1-yl)-N-(propan-2-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 572.65 |
| Molecular Formula: | C24 H34 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)Cc1ccc(cc1)S(Nc1cc(ccc1N1CCNCC1)C(NC(C)C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7562 |
| logD: | 3.7562 |
| logSw: | -4.1244 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.962 |
| InChI Key: | CBTIRSMCGVXMDY-UHFFFAOYSA-N |