4-(benzylsulfanyl)-2-(4-methoxyphenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidine
Chemical Structure Depiction of
4-(benzylsulfanyl)-2-(4-methoxyphenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidine
4-(benzylsulfanyl)-2-(4-methoxyphenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidine
Compound characteristics
Compound ID: | C683-0280 |
Compound Name: | 4-(benzylsulfanyl)-2-(4-methoxyphenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidine |
Molecular Weight: | 426.54 |
Molecular Formula: | C26 H22 N2 O2 S |
Smiles: | Cc1ccc2c(Cc3c(nc(c4ccc(cc4)OC)nc3SCc3ccccc3)O2)c1 |
Stereo: | ACHIRAL |
logP: | 7.2629 |
logD: | 7.2599 |
logSw: | -5.8946 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 33.674 |
InChI Key: | TUPMWLPSWAYISF-UHFFFAOYSA-N |