3-[(4-chlorophenyl)methyl]-2-{[(3-methoxyphenyl)methyl]sulfanyl}pteridin-4(3H)-one
Chemical Structure Depiction of
3-[(4-chlorophenyl)methyl]-2-{[(3-methoxyphenyl)methyl]sulfanyl}pteridin-4(3H)-one
3-[(4-chlorophenyl)methyl]-2-{[(3-methoxyphenyl)methyl]sulfanyl}pteridin-4(3H)-one
Compound characteristics
| Compound ID: | E196-0319 |
| Compound Name: | 3-[(4-chlorophenyl)methyl]-2-{[(3-methoxyphenyl)methyl]sulfanyl}pteridin-4(3H)-one |
| Molecular Weight: | 424.91 |
| Molecular Formula: | C21 H17 Cl N4 O2 S |
| Smiles: | COc1cccc(CSC2=Nc3c(C(N2Cc2ccc(cc2)[Cl])=O)nccn3)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.3195 |
| logD: | 4.3195 |
| logSw: | -4.6523 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.847 |
| InChI Key: | ZPHFGRSFLPFTTD-UHFFFAOYSA-N |