3-[(2-ethoxyphenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[(2-ethoxyphenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
3-[(2-ethoxyphenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C200-9299 |
| Compound Name: | 3-[(2-ethoxyphenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 527.59 |
| Molecular Formula: | C26 H20 F3 N3 O2 S2 |
| Smiles: | CCOc1ccccc1CN1C(=Nc2c3cccnc3sc2C1=O)SCc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.3509 |
| logD: | 6.3509 |
| logSw: | -5.8114 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.882 |
| InChI Key: | WQFFHAWIBMUBGT-UHFFFAOYSA-N |