N-[(4-ethylphenyl)methyl]-3-[(4-methylbenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[(4-ethylphenyl)methyl]-3-[(4-methylbenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
N-[(4-ethylphenyl)methyl]-3-[(4-methylbenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-1174 |
| Compound Name: | N-[(4-ethylphenyl)methyl]-3-[(4-methylbenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 606.66 |
| Molecular Formula: | C27 H32 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCc1ccc(CNC(c2ccc(c(c2)NS(c2ccc(C)cc2)(=O)=O)N2CCNCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2758 |
| logD: | 4.2758 |
| logSw: | -4.1512 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.716 |
| InChI Key: | HGWVHUOJJAIGDR-UHFFFAOYSA-N |