N-benzyl-5-[(2,4-dimethylbenzene-1-sulfonyl)amino]-N-methyl-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-benzyl-5-[(2,4-dimethylbenzene-1-sulfonyl)amino]-N-methyl-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
N-benzyl-5-[(2,4-dimethylbenzene-1-sulfonyl)amino]-N-methyl-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L268-0394 |
| Compound Name: | N-benzyl-5-[(2,4-dimethylbenzene-1-sulfonyl)amino]-N-methyl-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 606.66 |
| Molecular Formula: | C27 H32 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(c(C)c1)S(Nc1ccc(c(c1)C(N(C)Cc1ccccc1)=O)N1CCNCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2756 |
| logD: | 2.8001 |
| logSw: | -4.1718 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.151 |
| InChI Key: | FYKANWWXJMWYCQ-UHFFFAOYSA-N |