2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(furan-2-yl)methyl]pteridin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(furan-2-yl)methyl]pteridin-4(3H)-one
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(furan-2-yl)methyl]pteridin-4(3H)-one
Compound characteristics
Compound ID: | E196-0147 |
Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(furan-2-yl)methyl]pteridin-4(3H)-one |
Molecular Weight: | 384.84 |
Molecular Formula: | C18 H13 Cl N4 O2 S |
Smiles: | C(c1ccco1)N1C(=Nc2c(C1=O)nccn2)SCc1ccc(cc1)[Cl] |
Stereo: | ACHIRAL |
logP: | 3.24 |
logD: | 3.24 |
logSw: | -3.3854 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 53.052 |
InChI Key: | NSAILBFCYSODLS-UHFFFAOYSA-N |