3-benzyl-2-{[(3-fluorophenyl)methyl]sulfanyl}pteridin-4(3H)-one
Chemical Structure Depiction of
3-benzyl-2-{[(3-fluorophenyl)methyl]sulfanyl}pteridin-4(3H)-one
3-benzyl-2-{[(3-fluorophenyl)methyl]sulfanyl}pteridin-4(3H)-one
Compound characteristics
| Compound ID: | E196-0007 |
| Compound Name: | 3-benzyl-2-{[(3-fluorophenyl)methyl]sulfanyl}pteridin-4(3H)-one |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C20 H15 F N4 O S |
| Smiles: | C(c1ccccc1)N1C(=Nc2c(C1=O)nccn2)SCc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 3.7916 |
| logD: | 3.7916 |
| logSw: | -4.0325 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.304 |
| InChI Key: | AFZRGNVPIHHXSH-UHFFFAOYSA-N |