N-[4-(azepane-1-carbonyl)-1-phenyl-1H-pyrazol-5-yl]-4-methylbenzamide
Chemical Structure Depiction of
N-[4-(azepane-1-carbonyl)-1-phenyl-1H-pyrazol-5-yl]-4-methylbenzamide
N-[4-(azepane-1-carbonyl)-1-phenyl-1H-pyrazol-5-yl]-4-methylbenzamide
Compound characteristics
| Compound ID: | 3261-0068 |
| Compound Name: | N-[4-(azepane-1-carbonyl)-1-phenyl-1H-pyrazol-5-yl]-4-methylbenzamide |
| Molecular Weight: | 402.5 |
| Molecular Formula: | C24 H26 N4 O2 |
| Smiles: | Cc1ccc(cc1)C(Nc1c(cnn1c1ccccc1)C(N1CCCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3795 |
| logD: | 4.1737 |
| logSw: | -4.1166 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.046 |
| InChI Key: | RMWBUCUCEGWPHC-UHFFFAOYSA-N |