3-[(4-chlorophenyl)methyl]-2-{[(3-fluorophenyl)methyl]sulfanyl}pteridin-4(3H)-one
Chemical Structure Depiction of
3-[(4-chlorophenyl)methyl]-2-{[(3-fluorophenyl)methyl]sulfanyl}pteridin-4(3H)-one
3-[(4-chlorophenyl)methyl]-2-{[(3-fluorophenyl)methyl]sulfanyl}pteridin-4(3H)-one
Compound characteristics
| Compound ID: | E196-0295 |
| Compound Name: | 3-[(4-chlorophenyl)methyl]-2-{[(3-fluorophenyl)methyl]sulfanyl}pteridin-4(3H)-one |
| Molecular Weight: | 412.87 |
| Molecular Formula: | C20 H14 Cl F N4 O S |
| Smiles: | C(c1ccc(cc1)[Cl])N1C(=Nc2c(C1=O)nccn2)SCc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 4.3863 |
| logD: | 4.3863 |
| logSw: | -4.6455 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.304 |
| InChI Key: | RQRUZOILCREZHI-UHFFFAOYSA-N |