4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-[(pyridin-3-yl)methyl]-1H-pyrrole-3-sulfonamide
Chemical Structure Depiction of
4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-[(pyridin-3-yl)methyl]-1H-pyrrole-3-sulfonamide
4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-[(pyridin-3-yl)methyl]-1H-pyrrole-3-sulfonamide
Compound characteristics
| Compound ID: | G243-1631 |
| Compound Name: | 4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-[(pyridin-3-yl)methyl]-1H-pyrrole-3-sulfonamide |
| Molecular Weight: | 404.53 |
| Molecular Formula: | C20 H28 N4 O3 S |
| Smiles: | Cc1c(C(N2CCCCCC2)=O)c(c(C)n1C)S(NCc1cccnc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3614 |
| logD: | 1.3505 |
| logSw: | -1.8867 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.273 |
| InChI Key: | BOCWEHHWMFNWNB-UHFFFAOYSA-N |