2-{3,5-dimethyl-1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-pyrazol-4-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{3,5-dimethyl-1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-pyrazol-4-yl}-1-(pyrrolidin-1-yl)ethan-1-one
2-{3,5-dimethyl-1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-pyrazol-4-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | D458-0914 |
| Compound Name: | 2-{3,5-dimethyl-1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-pyrazol-4-yl}-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 380.51 |
| Molecular Formula: | C21 H24 N4 O S |
| Smiles: | Cc1ccc(cc1)c1csc(n1)n1c(C)c(CC(N2CCCC2)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5256 |
| logD: | 4.5229 |
| logSw: | -4.2285 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.692 |
| InChI Key: | IUOQYIAQPYQDBQ-UHFFFAOYSA-N |