3-benzyl-2-{[(2-chlorophenyl)methyl]sulfanyl}pteridin-4(3H)-one
Chemical Structure Depiction of
3-benzyl-2-{[(2-chlorophenyl)methyl]sulfanyl}pteridin-4(3H)-one
3-benzyl-2-{[(2-chlorophenyl)methyl]sulfanyl}pteridin-4(3H)-one
Compound characteristics
| Compound ID: | E196-0003 |
| Compound Name: | 3-benzyl-2-{[(2-chlorophenyl)methyl]sulfanyl}pteridin-4(3H)-one |
| Molecular Weight: | 394.88 |
| Molecular Formula: | C20 H15 Cl N4 O S |
| Smiles: | C(c1ccccc1)N1C(=Nc2c(C1=O)nccn2)SCc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.3282 |
| logD: | 4.3282 |
| logSw: | -4.4226 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.304 |
| InChI Key: | SUSJUARGQQNPJR-UHFFFAOYSA-N |