4-(azepane-1-sulfonyl)-N-(2,5-dimethoxyphenyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
4-(azepane-1-sulfonyl)-N-(2,5-dimethoxyphenyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide
4-(azepane-1-sulfonyl)-N-(2,5-dimethoxyphenyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | F379-1673 |
| Compound Name: | 4-(azepane-1-sulfonyl)-N-(2,5-dimethoxyphenyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 435.54 |
| Molecular Formula: | C21 H29 N3 O5 S |
| Smiles: | Cc1c(c(C)[nH]c1C(Nc1cc(ccc1OC)OC)=O)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1621 |
| logD: | 3.1208 |
| logSw: | -3.5035 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.829 |
| InChI Key: | TXTCXFGACLUZQP-UHFFFAOYSA-N |