2-{[2-(2-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[(4-fluorophenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(2-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[(4-fluorophenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
2-{[2-(2-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[(4-fluorophenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F399-0635 |
| Compound Name: | 2-{[2-(2-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[(4-fluorophenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 495.98 |
| Molecular Formula: | C24 H15 Cl F N3 O2 S2 |
| Smiles: | C(c1ccc(cc1)F)N1C(=Nc2c3cccnc3sc2C1=O)SCC(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4388 |
| logD: | 5.4388 |
| logSw: | -5.8915 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.918 |
| InChI Key: | BRFVYVCBFKJVQI-UHFFFAOYSA-N |