N-(butan-2-yl)-3-[(3,4-dimethylbenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(butan-2-yl)-3-[(3,4-dimethylbenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
N-(butan-2-yl)-3-[(3,4-dimethylbenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0890 |
| Compound Name: | N-(butan-2-yl)-3-[(3,4-dimethylbenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 558.62 |
| Molecular Formula: | C23 H32 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCC(C)NC(c1ccc(c(c1)NS(c1ccc(C)c(C)c1)(=O)=O)N1CCNCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1303 |
| logD: | 3.1303 |
| logSw: | -3.4949 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.429 |
| InChI Key: | PYLXTVNGLLXKSM-SFHVURJKSA-N |