7-(2,5-dimethoxyphenyl)-1-ethyl-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
7-(2,5-dimethoxyphenyl)-1-ethyl-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
7-(2,5-dimethoxyphenyl)-1-ethyl-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | Y504-7733 |
| Compound Name: | 7-(2,5-dimethoxyphenyl)-1-ethyl-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 411.4 |
| Molecular Formula: | C18 H16 F3 N3 O3 S |
| Smiles: | CCN1C(=NC(c2c(cc(c3cc(ccc3OC)OC)nc12)C(F)(F)F)=O)S |
| Stereo: | ACHIRAL |
| logP: | 4.1125 |
| logD: | 0.5904 |
| logSw: | -4.5399 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.084 |
| InChI Key: | BLLDNCFGSJNAKR-UHFFFAOYSA-N |