N-(3-chloro-4-methylphenyl)-4-[2-(4-chlorophenyl)-7-hydroxypyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carbothioamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-4-[2-(4-chlorophenyl)-7-hydroxypyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carbothioamide
N-(3-chloro-4-methylphenyl)-4-[2-(4-chlorophenyl)-7-hydroxypyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carbothioamide
Compound characteristics
| Compound ID: | C429-0191 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-4-[2-(4-chlorophenyl)-7-hydroxypyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carbothioamide |
| Molecular Weight: | 512.46 |
| Molecular Formula: | C25 H23 Cl2 N5 O S |
| Smiles: | Cc1ccc(cc1[Cl])NC(N1CCC(CC1)c1cc(n2c(cc(c3ccc(cc3)[Cl])n2)n1)O)=S |
| Stereo: | ACHIRAL |
| logP: | 6.9321 |
| logD: | 6.3291 |
| logSw: | -6.1598 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.495 |
| InChI Key: | RGHAXFYCPWOYLZ-UHFFFAOYSA-N |