3-[(oxolan-2-yl)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-[(oxolan-2-yl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
3-[(oxolan-2-yl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F399-0582 |
| Compound Name: | 3-[(oxolan-2-yl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 477.53 |
| Molecular Formula: | C22 H18 F3 N3 O2 S2 |
| Smiles: | C1CC(CN2C(=Nc3c4cccnc4sc3C2=O)SCc2cccc(c2)C(F)(F)F)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4536 |
| logD: | 4.4536 |
| logSw: | -4.4956 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.326 |
| InChI Key: | DDVGSEFICNGJEX-OAHLLOKOSA-N |