N-butyl-N-methyl-5-[(4-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-butyl-N-methyl-5-[(4-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
N-butyl-N-methyl-5-[(4-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L268-0243 |
| Compound Name: | N-butyl-N-methyl-5-[(4-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 558.62 |
| Molecular Formula: | C23 H32 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCCCN(C)C(c1cc(ccc1N1CCNCC1)NS(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1541 |
| logD: | 1.6786 |
| logSw: | -3.6713 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.401 |
| InChI Key: | APWNYVVTYRHQGL-UHFFFAOYSA-N |