5-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]-N-[(oxolan-2-yl)methyl]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]-N-[(oxolan-2-yl)methyl]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
5-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]-N-[(oxolan-2-yl)methyl]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L268-0810 |
| Compound Name: | 5-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]-N-[(oxolan-2-yl)methyl]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 607.05 |
| Molecular Formula: | C23 H29 Cl N4 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(cc1[Cl])S(Nc1ccc(c(c1)C(NCC1CCCO1)=O)N1CCNCC1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8741 |
| logD: | 1.3986 |
| logSw: | -3.5956 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.068 |
| InChI Key: | NYRQBZMXYQHGBA-GOSISDBHSA-N |