4-(azepane-1-sulfonyl)-N-(4-bromo-3-methylphenyl)-1-methyl-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
4-(azepane-1-sulfonyl)-N-(4-bromo-3-methylphenyl)-1-methyl-1H-pyrrole-2-carboxamide
4-(azepane-1-sulfonyl)-N-(4-bromo-3-methylphenyl)-1-methyl-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | G636-2490 |
| Compound Name: | 4-(azepane-1-sulfonyl)-N-(4-bromo-3-methylphenyl)-1-methyl-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 454.38 |
| Molecular Formula: | C19 H24 Br N3 O3 S |
| Smiles: | Cc1cc(ccc1[Br])NC(c1cc(cn1C)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9782 |
| logD: | 3.9682 |
| logSw: | -3.8571 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.681 |
| InChI Key: | KOWDZODJJSYUTB-UHFFFAOYSA-N |