7-(5-methylthiophen-2-yl)-1-[(oxolan-2-yl)methyl]-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
7-(5-methylthiophen-2-yl)-1-[(oxolan-2-yl)methyl]-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
7-(5-methylthiophen-2-yl)-1-[(oxolan-2-yl)methyl]-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | Y504-6663 |
| Compound Name: | 7-(5-methylthiophen-2-yl)-1-[(oxolan-2-yl)methyl]-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 427.47 |
| Molecular Formula: | C18 H16 F3 N3 O2 S2 |
| Smiles: | Cc1ccc(c2cc(c3C(N=C(N(CC4CCCO4)c3n2)S)=O)C(F)(F)F)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4325 |
| logD: | 0.9105 |
| logSw: | -4.59 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.586 |
| InChI Key: | UNCDWAOFYKULBF-SNVBAGLBSA-N |