{4-[(2-chlorophenyl)methyl]piperazin-1-yl}(1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3-yl)methanone
Chemical Structure Depiction of
{4-[(2-chlorophenyl)methyl]piperazin-1-yl}(1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3-yl)methanone
{4-[(2-chlorophenyl)methyl]piperazin-1-yl}(1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3-yl)methanone
Compound characteristics
| Compound ID: | Y043-4734 |
| Compound Name: | {4-[(2-chlorophenyl)methyl]piperazin-1-yl}(1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3-yl)methanone |
| Molecular Weight: | 372.9 |
| Molecular Formula: | C20 H25 Cl N4 O |
| Smiles: | C1CCc2c(C(N3CCN(CC3)Cc3ccccc3[Cl])=O)n[nH]c2CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.2995 |
| logD: | 3.2951 |
| logSw: | -3.4315 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.711 |
| InChI Key: | KFEJSSAEAWXBFM-UHFFFAOYSA-N |