9-methoxy-4-(methylsulfanyl)-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidine
Chemical Structure Depiction of
9-methoxy-4-(methylsulfanyl)-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidine
9-methoxy-4-(methylsulfanyl)-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | C683-0094 |
| Compound Name: | 9-methoxy-4-(methylsulfanyl)-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidine |
| Molecular Weight: | 336.41 |
| Molecular Formula: | C19 H16 N2 O2 S |
| Smiles: | COc1cccc2Cc3c(nc(c4ccccc4)nc3SC)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 5.564 |
| logD: | 5.561 |
| logSw: | -5.7793 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.717 |
| InChI Key: | DSXYWNRJDHDIRP-UHFFFAOYSA-N |