3-benzyl-2-{[(4-methylphenyl)methyl]sulfanyl}pteridin-4(3H)-one
Chemical Structure Depiction of
3-benzyl-2-{[(4-methylphenyl)methyl]sulfanyl}pteridin-4(3H)-one
3-benzyl-2-{[(4-methylphenyl)methyl]sulfanyl}pteridin-4(3H)-one
Compound characteristics
| Compound ID: | E196-0010 |
| Compound Name: | 3-benzyl-2-{[(4-methylphenyl)methyl]sulfanyl}pteridin-4(3H)-one |
| Molecular Weight: | 374.46 |
| Molecular Formula: | C21 H18 N4 O S |
| Smiles: | Cc1ccc(CSC2=Nc3c(C(N2Cc2ccccc2)=O)nccn3)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8153 |
| logD: | 3.8153 |
| logSw: | -3.8094 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.304 |
| InChI Key: | RPWLRMXNEMCUDU-UHFFFAOYSA-N |