4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-(2-methylphenyl)-1H-pyrrole-3-sulfonamide
Chemical Structure Depiction of
4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-(2-methylphenyl)-1H-pyrrole-3-sulfonamide
4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-(2-methylphenyl)-1H-pyrrole-3-sulfonamide
Compound characteristics
| Compound ID: | G243-1703 |
| Compound Name: | 4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-(2-methylphenyl)-1H-pyrrole-3-sulfonamide |
| Molecular Weight: | 403.54 |
| Molecular Formula: | C21 H29 N3 O3 S |
| Smiles: | Cc1ccccc1NS(c1c(C(N2CCCCCC2)=O)c(C)n(C)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8815 |
| logD: | 2.8485 |
| logSw: | -3.2815 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.949 |
| InChI Key: | MDGJGWXNPXMCKW-UHFFFAOYSA-N |