5-(azepane-1-sulfonyl)-N-[(4-methylphenyl)methyl]thiophene-2-carboxamide
Chemical Structure Depiction of
5-(azepane-1-sulfonyl)-N-[(4-methylphenyl)methyl]thiophene-2-carboxamide
5-(azepane-1-sulfonyl)-N-[(4-methylphenyl)methyl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | F561-0281 |
| Compound Name: | 5-(azepane-1-sulfonyl)-N-[(4-methylphenyl)methyl]thiophene-2-carboxamide |
| Molecular Weight: | 392.54 |
| Molecular Formula: | C19 H24 N2 O3 S2 |
| Smiles: | Cc1ccc(CNC(c2ccc(s2)S(N2CCCCCC2)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8425 |
| logD: | 3.8425 |
| logSw: | -3.7912 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.712 |
| InChI Key: | YMXRJDKJKAXAIP-UHFFFAOYSA-N |