2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(2-methoxyphenyl)methyl]pteridin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(2-methoxyphenyl)methyl]pteridin-4(3H)-one
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(2-methoxyphenyl)methyl]pteridin-4(3H)-one
Compound characteristics
| Compound ID: | E196-0193 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(2-methoxyphenyl)methyl]pteridin-4(3H)-one |
| Molecular Weight: | 424.91 |
| Molecular Formula: | C21 H17 Cl N4 O2 S |
| Smiles: | COc1ccccc1CN1C(=Nc2c(C1=O)nccn2)SCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.9386 |
| logD: | 3.9386 |
| logSw: | -4.3874 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.934 |
| InChI Key: | SXKCYAVFQQYLRA-UHFFFAOYSA-N |