3-{3,5-dimethyl-1-[6-(pyrrolidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Chemical Structure Depiction of
3-{3,5-dimethyl-1-[6-(pyrrolidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
3-{3,5-dimethyl-1-[6-(pyrrolidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | F644-0193 |
| Compound Name: | 3-{3,5-dimethyl-1-[6-(pyrrolidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide |
| Molecular Weight: | 450.61 |
| Molecular Formula: | C24 H30 N6 O S |
| Smiles: | Cc1c(CCC(NCc2ccc(cc2)SC)=O)c(C)n(c2cc(ncn2)N2CCCC2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.2712 |
| logD: | 4.2373 |
| logSw: | -4.256 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.412 |
| InChI Key: | BMKHXQVKADAXJU-UHFFFAOYSA-N |