3-{3,5-dimethyl-1-[6-(pyrrolidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Chemical Structure Depiction of
3-{3,5-dimethyl-1-[6-(pyrrolidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
3-{3,5-dimethyl-1-[6-(pyrrolidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Compound characteristics
| Compound ID: | F644-0207 |
| Compound Name: | 3-{3,5-dimethyl-1-[6-(pyrrolidin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide |
| Molecular Weight: | 464.63 |
| Molecular Formula: | C25 H32 N6 O S |
| Smiles: | Cc1c(CCC(NCCc2ccc(cc2)SC)=O)c(C)n(c2cc(ncn2)N2CCCC2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.046 |
| logD: | 4.012 |
| logSw: | -4.1354 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.253 |
| InChI Key: | OISXACATDXRGFX-UHFFFAOYSA-N |