4-(azepane-1-sulfonyl)-N-(3,4-dimethoxyphenyl)-1-methyl-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
4-(azepane-1-sulfonyl)-N-(3,4-dimethoxyphenyl)-1-methyl-1H-pyrrole-2-carboxamide
4-(azepane-1-sulfonyl)-N-(3,4-dimethoxyphenyl)-1-methyl-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | G636-2364 |
| Compound Name: | 4-(azepane-1-sulfonyl)-N-(3,4-dimethoxyphenyl)-1-methyl-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 421.51 |
| Molecular Formula: | C20 H27 N3 O5 S |
| Smiles: | Cn1cc(cc1C(Nc1ccc(c(c1)OC)OC)=O)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3386 |
| logD: | 2.3336 |
| logSw: | -2.9563 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.942 |
| InChI Key: | QPHQGTLQWPOPLL-UHFFFAOYSA-N |