N-[2-(azepan-1-yl)ethyl]-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
N-[2-(azepan-1-yl)ethyl]-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | E751-3301 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 391.52 |
| Molecular Formula: | C23 H29 N5 O |
| Smiles: | Cc1ccc(cc1)n1c(c(cn1)C(NCCN1CCCCCC1)=O)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6724 |
| logD: | 3.6957 |
| logSw: | -4.0693 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.663 |
| InChI Key: | JOCTVBUJOZCHPB-UHFFFAOYSA-N |