N-[(3-methylphenyl)methyl]-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[(3-methylphenyl)methyl]-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
N-[(3-methylphenyl)methyl]-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-1131 |
| Compound Name: | N-[(3-methylphenyl)methyl]-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 584.64 |
| Molecular Formula: | C23 H26 N4 O3 S2 |
| Salt: | CF3COOH |
| Smiles: | Cc1cccc(CNC(c2ccc(c(c2)NS(c2cccs2)(=O)=O)N2CCNCC2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.3732 |
| logD: | 3.3732 |
| logSw: | -3.7461 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.734 |
| InChI Key: | IGMYNEFVRPXVPP-UHFFFAOYSA-N |