1-(2,3-dimethylphenyl)-7-(1-methyl-1H-pyrazol-3-yl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
1-(2,3-dimethylphenyl)-7-(1-methyl-1H-pyrazol-3-yl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
1-(2,3-dimethylphenyl)-7-(1-methyl-1H-pyrazol-3-yl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | Y504-7886 |
| Compound Name: | 1-(2,3-dimethylphenyl)-7-(1-methyl-1H-pyrazol-3-yl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 431.44 |
| Molecular Formula: | C20 H16 F3 N5 O S |
| Smiles: | Cc1cccc(c1C)N1C(=NC(c2c(cc(c3ccn(C)n3)nc12)C(F)(F)F)=O)S |
| Stereo: | ACHIRAL |
| logP: | 4.2342 |
| logD: | 4.2342 |
| logSw: | -4.5993 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.693 |
| InChI Key: | CVUOODAVYIOHKS-UHFFFAOYSA-N |