3-{5-hydroxy-3-methyl-1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-pyrazol-4-yl}-1-(4-phenylpiperazin-1-yl)propan-1-one
Chemical Structure Depiction of
3-{5-hydroxy-3-methyl-1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-pyrazol-4-yl}-1-(4-phenylpiperazin-1-yl)propan-1-one
3-{5-hydroxy-3-methyl-1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-pyrazol-4-yl}-1-(4-phenylpiperazin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | D475-2487 |
| Compound Name: | 3-{5-hydroxy-3-methyl-1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-pyrazol-4-yl}-1-(4-phenylpiperazin-1-yl)propan-1-one |
| Molecular Weight: | 487.62 |
| Molecular Formula: | C27 H29 N5 O2 S |
| Smiles: | Cc1ccc(cc1)c1csc(n1)n1c(c(CCC(N2CCN(CC2)c2ccccc2)=O)c(C)n1)O |
| Stereo: | ACHIRAL |
| logP: | 4.7398 |
| logD: | 2.7535 |
| logSw: | -4.4616 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.018 |
| InChI Key: | WPDCTECSTJTJGJ-UHFFFAOYSA-N |