1-butyl-7-(furan-2-yl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
1-butyl-7-(furan-2-yl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
1-butyl-7-(furan-2-yl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | Y501-3591 |
| Compound Name: | 1-butyl-7-(furan-2-yl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 369.36 |
| Molecular Formula: | C16 H14 F3 N3 O2 S |
| Smiles: | CCCCN1C(=NC(c2c(cc(c3ccco3)nc12)C(F)(F)F)=O)S |
| Stereo: | ACHIRAL |
| logP: | 4.2978 |
| logD: | 0.7758 |
| logSw: | -4.2346 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.742 |
| InChI Key: | COQYWGOUDIDEEV-UHFFFAOYSA-N |