3-[({3-[(4-fluorophenyl)methyl]-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl}sulfanyl)methyl]-4-methoxybenzaldehyde
Chemical Structure Depiction of
3-[({3-[(4-fluorophenyl)methyl]-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl}sulfanyl)methyl]-4-methoxybenzaldehyde
3-[({3-[(4-fluorophenyl)methyl]-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl}sulfanyl)methyl]-4-methoxybenzaldehyde
Compound characteristics
| Compound ID: | F399-0644 |
| Compound Name: | 3-[({3-[(4-fluorophenyl)methyl]-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl}sulfanyl)methyl]-4-methoxybenzaldehyde |
| Molecular Weight: | 491.56 |
| Molecular Formula: | C25 H18 F N3 O3 S2 |
| Smiles: | COc1ccc(C=O)cc1CSC1=Nc2c3cccnc3sc2C(N1Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8907 |
| logD: | 4.8906 |
| logSw: | -4.9756 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.461 |
| InChI Key: | YUPHZOZGEUWKHO-UHFFFAOYSA-N |