(4-benzylpiperazin-1-yl)[1-(3-chloro-2-methylphenyl)-5-(piperidin-4-yl)-1H-pyrazol-4-yl]methanone--hydrogen chloride (1/1)
Chemical Structure Depiction of
(4-benzylpiperazin-1-yl)[1-(3-chloro-2-methylphenyl)-5-(piperidin-4-yl)-1H-pyrazol-4-yl]methanone--hydrogen chloride (1/1)
(4-benzylpiperazin-1-yl)[1-(3-chloro-2-methylphenyl)-5-(piperidin-4-yl)-1H-pyrazol-4-yl]methanone--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E922-2135 |
| Compound Name: | (4-benzylpiperazin-1-yl)[1-(3-chloro-2-methylphenyl)-5-(piperidin-4-yl)-1H-pyrazol-4-yl]methanone--hydrogen chloride (1/1) |
| Molecular Weight: | 514.5 |
| Molecular Formula: | C27 H32 Cl N5 O |
| Salt: | HCl |
| Smiles: | Cc1c(cccc1[Cl])n1c(C2CCNCC2)c(cn1)C(N1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1476 |
| logD: | -0.3334 |
| logSw: | -3.5227 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.102 |
| InChI Key: | AAQRASAAIVUZCR-UHFFFAOYSA-N |