3-[(2-methoxyphenyl)methyl]-2-{[(4-methylphenyl)methyl]sulfanyl}pteridin-4(3H)-one
Chemical Structure Depiction of
3-[(2-methoxyphenyl)methyl]-2-{[(4-methylphenyl)methyl]sulfanyl}pteridin-4(3H)-one
3-[(2-methoxyphenyl)methyl]-2-{[(4-methylphenyl)methyl]sulfanyl}pteridin-4(3H)-one
Compound characteristics
| Compound ID: | E196-0196 |
| Compound Name: | 3-[(2-methoxyphenyl)methyl]-2-{[(4-methylphenyl)methyl]sulfanyl}pteridin-4(3H)-one |
| Molecular Weight: | 404.49 |
| Molecular Formula: | C22 H20 N4 O2 S |
| Smiles: | Cc1ccc(CSC2=Nc3c(C(N2Cc2ccccc2OC)=O)nccn3)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7673 |
| logD: | 3.7673 |
| logSw: | -3.8611 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.934 |
| InChI Key: | YLMCAXIYKRTXAU-UHFFFAOYSA-N |