{2-[5-hydroxy-3-methyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-1,3-thiazol-5-yl}(4-phenylpiperazin-1-yl)methanone
Chemical Structure Depiction of
{2-[5-hydroxy-3-methyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-1,3-thiazol-5-yl}(4-phenylpiperazin-1-yl)methanone
{2-[5-hydroxy-3-methyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-1,3-thiazol-5-yl}(4-phenylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | D475-2259 |
| Compound Name: | {2-[5-hydroxy-3-methyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-1,3-thiazol-5-yl}(4-phenylpiperazin-1-yl)methanone |
| Molecular Weight: | 453.61 |
| Molecular Formula: | C24 H31 N5 O2 S |
| Smiles: | CC(C)CCc1c(C)nn(c1O)c1nc(C)c(C(N2CCN(CC2)c2ccccc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.3604 |
| logD: | 2.7446 |
| logSw: | -4.1112 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.394 |
| InChI Key: | XNVVFNOMTHCBRW-UHFFFAOYSA-N |