4-(azepane-1-carbonyl)-N-[(4-bromophenyl)methyl]-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide
Chemical Structure Depiction of
4-(azepane-1-carbonyl)-N-[(4-bromophenyl)methyl]-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide
4-(azepane-1-carbonyl)-N-[(4-bromophenyl)methyl]-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide
Compound characteristics
| Compound ID: | G243-1973 |
| Compound Name: | 4-(azepane-1-carbonyl)-N-[(4-bromophenyl)methyl]-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide |
| Molecular Weight: | 482.44 |
| Molecular Formula: | C21 H28 Br N3 O3 S |
| Smiles: | Cc1c(C(N2CCCCCC2)=O)c(c(C)n1C)S(NCc1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.423 |
| logD: | 3.4198 |
| logSw: | -3.8928 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.755 |
| InChI Key: | CCPKZMRVXBIYEZ-UHFFFAOYSA-N |