4-(azepane-1-sulfonyl)-N-[2-(cyclohex-1-en-1-yl)ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
4-(azepane-1-sulfonyl)-N-[2-(cyclohex-1-en-1-yl)ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
4-(azepane-1-sulfonyl)-N-[2-(cyclohex-1-en-1-yl)ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | F379-1582 |
| Compound Name: | 4-(azepane-1-sulfonyl)-N-[2-(cyclohex-1-en-1-yl)ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 407.57 |
| Molecular Formula: | C21 H33 N3 O3 S |
| Smiles: | Cc1c(c(C)[nH]c1C(NCCC1CCCCC=1)=O)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2598 |
| logD: | 3.2598 |
| logSw: | -3.3163 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.709 |
| InChI Key: | QMPNXPCAWZYIEG-UHFFFAOYSA-N |