4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-[4-(trifluoromethoxy)phenyl]-1H-pyrrole-3-sulfonamide
Chemical Structure Depiction of
4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-[4-(trifluoromethoxy)phenyl]-1H-pyrrole-3-sulfonamide
4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-[4-(trifluoromethoxy)phenyl]-1H-pyrrole-3-sulfonamide
Compound characteristics
| Compound ID: | G243-1800 |
| Compound Name: | 4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-[4-(trifluoromethoxy)phenyl]-1H-pyrrole-3-sulfonamide |
| Molecular Weight: | 473.51 |
| Molecular Formula: | C21 H26 F3 N3 O4 S |
| Smiles: | Cc1c(C(N2CCCCCC2)=O)c(c(C)n1C)S(Nc1ccc(cc1)OC(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0658 |
| logD: | 4.026 |
| logSw: | -4.2038 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.583 |
| InChI Key: | ZFMYJWYELGWGGP-UHFFFAOYSA-N |