3-[(3-methylbenzene-1-sulfonyl)amino]-N-[(3-methylphenyl)methyl]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-[(3-methylbenzene-1-sulfonyl)amino]-N-[(3-methylphenyl)methyl]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
3-[(3-methylbenzene-1-sulfonyl)amino]-N-[(3-methylphenyl)methyl]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-1138 |
| Compound Name: | 3-[(3-methylbenzene-1-sulfonyl)amino]-N-[(3-methylphenyl)methyl]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 592.64 |
| Molecular Formula: | C26 H30 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1cccc(CNC(c2ccc(c(c2)NS(c2cccc(C)c2)(=O)=O)N2CCNCC2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.9388 |
| logD: | 3.9388 |
| logSw: | -3.9646 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.716 |
| InChI Key: | MYDNGIZRCOUKKE-UHFFFAOYSA-N |