N-[3-(azepan-1-yl)propyl]-1-(3-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-1-(3-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
N-[3-(azepan-1-yl)propyl]-1-(3-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | G013-0314 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-1-(3-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 405.54 |
| Molecular Formula: | C24 H31 N5 O |
| Smiles: | Cc1cccc(c1)n1c(c(cn1)C(NCCCN1CCCCCC1)=O)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8656 |
| logD: | 2.295 |
| logSw: | -4.2738 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.663 |
| InChI Key: | OMBSXLHEFIURGG-UHFFFAOYSA-N |