4-(benzylsulfanyl)-2-(4-ethoxyphenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidine
Chemical Structure Depiction of
4-(benzylsulfanyl)-2-(4-ethoxyphenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidine
4-(benzylsulfanyl)-2-(4-ethoxyphenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | C683-0393 |
| Compound Name: | 4-(benzylsulfanyl)-2-(4-ethoxyphenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidine |
| Molecular Weight: | 440.56 |
| Molecular Formula: | C27 H24 N2 O2 S |
| Smiles: | CCOc1ccc(cc1)c1nc2c(Cc3cc(C)ccc3O2)c(n1)SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 7.6495 |
| logD: | 7.6465 |
| logSw: | -5.9077 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.254 |
| InChI Key: | RVUHTQSDZAHPKU-UHFFFAOYSA-N |