[1-(3-chloro-2-methylphenyl)-5-(piperidin-4-yl)-1H-pyrazol-4-yl][4-(4-methoxyphenyl)piperazin-1-yl]methanone--hydrogen chloride (1/1)
Chemical Structure Depiction of
[1-(3-chloro-2-methylphenyl)-5-(piperidin-4-yl)-1H-pyrazol-4-yl][4-(4-methoxyphenyl)piperazin-1-yl]methanone--hydrogen chloride (1/1)
[1-(3-chloro-2-methylphenyl)-5-(piperidin-4-yl)-1H-pyrazol-4-yl][4-(4-methoxyphenyl)piperazin-1-yl]methanone--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E922-2216 |
| Compound Name: | [1-(3-chloro-2-methylphenyl)-5-(piperidin-4-yl)-1H-pyrazol-4-yl][4-(4-methoxyphenyl)piperazin-1-yl]methanone--hydrogen chloride (1/1) |
| Molecular Weight: | 530.5 |
| Molecular Formula: | C27 H32 Cl N5 O2 |
| Salt: | HCl |
| Smiles: | Cc1c(cccc1[Cl])n1c(C2CCNCC2)c(cn1)C(N1CCN(CC1)c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5705 |
| logD: | 0.0895 |
| logSw: | -3.8842 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.366 |
| InChI Key: | RORINXYERMSYCE-UHFFFAOYSA-N |