1-(butan-2-yl)-7-(4-ethylphenyl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
1-(butan-2-yl)-7-(4-ethylphenyl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
1-(butan-2-yl)-7-(4-ethylphenyl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | Y504-7949 |
| Compound Name: | 1-(butan-2-yl)-7-(4-ethylphenyl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 407.46 |
| Molecular Formula: | C20 H20 F3 N3 O S |
| Smiles: | CCC(C)N1C(=NC(c2c(cc(c3ccc(CC)cc3)nc12)C(F)(F)F)=O)S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1833 |
| logD: | 3.0929 |
| logSw: | -5.5815 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.49 |
| InChI Key: | BZVQPPFSRGDYNV-NSHDSACASA-N |