4-(azepane-1-sulfonyl)-1-methyl-N-[(4-methylphenyl)methyl]-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
4-(azepane-1-sulfonyl)-1-methyl-N-[(4-methylphenyl)methyl]-1H-pyrrole-2-carboxamide
4-(azepane-1-sulfonyl)-1-methyl-N-[(4-methylphenyl)methyl]-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | G636-2427 |
| Compound Name: | 4-(azepane-1-sulfonyl)-1-methyl-N-[(4-methylphenyl)methyl]-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 389.52 |
| Molecular Formula: | C20 H27 N3 O3 S |
| Smiles: | Cc1ccc(CNC(c2cc(cn2C)S(N2CCCCCC2)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9705 |
| logD: | 2.9704 |
| logSw: | -3.3634 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.004 |
| InChI Key: | SBZYPKBZBBFZFU-UHFFFAOYSA-N |