2-(4-methylphenyl)-1-[4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-methylphenyl)-1-[4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one
2-(4-methylphenyl)-1-[4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | P803-0902 |
| Compound Name: | 2-(4-methylphenyl)-1-[4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one |
| Molecular Weight: | 374.48 |
| Molecular Formula: | C23 H26 N4 O |
| Smiles: | Cc1ccc(CC(N2CCCN(CC2)c2cc(c3ccccc3)n[nH]2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2411 |
| logD: | 4.2411 |
| logSw: | -4.1891 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.904 |
| InChI Key: | ZOHJRFKELPXSPD-UHFFFAOYSA-N |