3-[(4-fluorophenyl)methyl]-2-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[(4-fluorophenyl)methyl]-2-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
3-[(4-fluorophenyl)methyl]-2-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F399-0638 |
| Compound Name: | 3-[(4-fluorophenyl)methyl]-2-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 491.56 |
| Molecular Formula: | C25 H18 F N3 O3 S2 |
| Smiles: | COc1cccc(c1)C(CSC1=Nc2c3cccnc3sc2C(N1Cc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1055 |
| logD: | 5.1055 |
| logSw: | -5.2715 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.462 |
| InChI Key: | CCVMHXRJWLFCGF-UHFFFAOYSA-N |