3-[(4-methoxyphenyl)methyl]-2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}pyrido[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[(4-methoxyphenyl)methyl]-2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}pyrido[2,3-d]pyrimidin-4(3H)-one
3-[(4-methoxyphenyl)methyl]-2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}pyrido[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C724-0223 |
| Compound Name: | 3-[(4-methoxyphenyl)methyl]-2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}pyrido[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 457.51 |
| Molecular Formula: | C24 H19 N5 O3 S |
| Smiles: | COc1ccc(CN2C(=Nc3c(cccn3)C2=O)SCC2=CC(N3C=CC=CC3=N2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8622 |
| logD: | 2.8621 |
| logSw: | -3.387 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.925 |
| InChI Key: | QDFMZTMPDMFYDH-UHFFFAOYSA-N |