3-[1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-1-[4-(4-fluorophenyl)piperazin-1-yl]propan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-[1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-1-[4-(4-fluorophenyl)piperazin-1-yl]propan-1-one--hydrogen chloride (1/1)
3-[1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-1-[4-(4-fluorophenyl)piperazin-1-yl]propan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D475-2767 |
| Compound Name: | 3-[1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-1-[4-(4-fluorophenyl)piperazin-1-yl]propan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 480 |
| Molecular Formula: | C22 H26 F N5 O2 S |
| Salt: | HCl |
| Smiles: | Cc1c(C)sc(n1)n1c(c(CCC(N2CCN(CC2)c2ccc(cc2)F)=O)c(C)n1)O |
| Stereo: | ACHIRAL |
| logP: | 2.8856 |
| logD: | 2.8856 |
| logSw: | -3.1035 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.867 |
| InChI Key: | OFOHPKPGHBIITI-UHFFFAOYSA-N |