4-(azepane-1-carbonyl)-N-(3-fluoro-4-methylphenyl)-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide
Chemical Structure Depiction of
4-(azepane-1-carbonyl)-N-(3-fluoro-4-methylphenyl)-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide
4-(azepane-1-carbonyl)-N-(3-fluoro-4-methylphenyl)-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide
Compound characteristics
| Compound ID: | G243-1773 |
| Compound Name: | 4-(azepane-1-carbonyl)-N-(3-fluoro-4-methylphenyl)-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide |
| Molecular Weight: | 421.53 |
| Molecular Formula: | C21 H28 F N3 O3 S |
| Smiles: | Cc1ccc(cc1F)NS(c1c(C(N2CCCCCC2)=O)c(C)n(C)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4913 |
| logD: | 2.7463 |
| logSw: | -4.1045 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.646 |
| InChI Key: | PXPAAYJFLJZHKQ-UHFFFAOYSA-N |