3-[(4-methoxybenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)-N-(propan-2-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-[(4-methoxybenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)-N-(propan-2-yl)benzamide--trifluoroacetic acid (1/1)
3-[(4-methoxybenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)-N-(propan-2-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0763 |
| Compound Name: | 3-[(4-methoxybenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)-N-(propan-2-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 546.56 |
| Molecular Formula: | C21 H28 N4 O4 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)NC(c1ccc(c(c1)NS(c1ccc(cc1)OC)(=O)=O)N1CCNCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0581 |
| logD: | 2.0581 |
| logSw: | -3.0327 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.505 |
| InChI Key: | HSPVMCLFSHKJIG-UHFFFAOYSA-N |