4-(benzylsulfanyl)-7-methyl-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidine
Chemical Structure Depiction of
4-(benzylsulfanyl)-7-methyl-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidine
4-(benzylsulfanyl)-7-methyl-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | C683-0053 |
| Compound Name: | 4-(benzylsulfanyl)-7-methyl-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidine |
| Molecular Weight: | 396.51 |
| Molecular Formula: | C25 H20 N2 O S |
| Smiles: | Cc1ccc2c(Cc3c(nc(c4ccccc4)nc3SCc3ccccc3)O2)c1 |
| Stereo: | ACHIRAL |
| logP: | 7.1755 |
| logD: | 7.1724 |
| logSw: | -5.8434 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.1307 |
| InChI Key: | VIWLHFNXNYWTPR-UHFFFAOYSA-N |