2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(4-methylphenyl)methyl]pteridin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(4-methylphenyl)methyl]pteridin-4(3H)-one
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(4-methylphenyl)methyl]pteridin-4(3H)-one
Compound characteristics
| Compound ID: | E196-0474 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(4-methylphenyl)methyl]pteridin-4(3H)-one |
| Molecular Weight: | 408.91 |
| Molecular Formula: | C21 H17 Cl N4 O S |
| Smiles: | Cc1ccc(CN2C(=Nc3c(C2=O)nccn3)SCc2ccc(cc2)[Cl])cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.41 |
| logD: | 4.41 |
| logSw: | -4.5656 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.304 |
| InChI Key: | ZRGHMFARGYWOKJ-UHFFFAOYSA-N |