3-benzyl-2-{[(3-methoxyphenyl)methyl]sulfanyl}pteridin-4(3H)-one
Chemical Structure Depiction of
3-benzyl-2-{[(3-methoxyphenyl)methyl]sulfanyl}pteridin-4(3H)-one
3-benzyl-2-{[(3-methoxyphenyl)methyl]sulfanyl}pteridin-4(3H)-one
Compound characteristics
| Compound ID: | E196-0039 |
| Compound Name: | 3-benzyl-2-{[(3-methoxyphenyl)methyl]sulfanyl}pteridin-4(3H)-one |
| Molecular Weight: | 390.46 |
| Molecular Formula: | C21 H18 N4 O2 S |
| Smiles: | COc1cccc(CSC2=Nc3c(C(N2Cc2ccccc2)=O)nccn3)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.7248 |
| logD: | 3.7248 |
| logSw: | -4.0554 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.847 |
| InChI Key: | KSDHTRWKTRJDMQ-UHFFFAOYSA-N |