2-{[(4-ethenylphenyl)methyl]sulfanyl}-3-[(4-fluorophenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-ethenylphenyl)methyl]sulfanyl}-3-[(4-fluorophenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
2-{[(4-ethenylphenyl)methyl]sulfanyl}-3-[(4-fluorophenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F399-0244 |
| Compound Name: | 2-{[(4-ethenylphenyl)methyl]sulfanyl}-3-[(4-fluorophenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 459.56 |
| Molecular Formula: | C25 H18 F N3 O S2 |
| Smiles: | C=Cc1ccc(CSC2=Nc3c4cccnc4sc3C(N2Cc2ccc(cc2)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5999 |
| logD: | 5.5999 |
| logSw: | -6.0145 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.672 |
| InChI Key: | NGOXLXVZRVIIQR-UHFFFAOYSA-N |