4-(azepane-1-carbonyl)-N-(2,4-dimethylphenyl)-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide
Chemical Structure Depiction of
4-(azepane-1-carbonyl)-N-(2,4-dimethylphenyl)-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide
4-(azepane-1-carbonyl)-N-(2,4-dimethylphenyl)-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide
Compound characteristics
| Compound ID: | G243-1711 |
| Compound Name: | 4-(azepane-1-carbonyl)-N-(2,4-dimethylphenyl)-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide |
| Molecular Weight: | 417.57 |
| Molecular Formula: | C22 H31 N3 O3 S |
| Smiles: | Cc1ccc(c(C)c1)NS(c1c(C(N2CCCCCC2)=O)c(C)n(C)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5693 |
| logD: | 3.5262 |
| logSw: | -3.9618 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.949 |
| InChI Key: | WUBGKNXQZSIRIR-UHFFFAOYSA-N |