2-(4-chlorophenyl)-7-methyl-4-(methylsulfanyl)-5H-[1]benzopyrano[2,3-d]pyrimidine
Chemical Structure Depiction of
2-(4-chlorophenyl)-7-methyl-4-(methylsulfanyl)-5H-[1]benzopyrano[2,3-d]pyrimidine
2-(4-chlorophenyl)-7-methyl-4-(methylsulfanyl)-5H-[1]benzopyrano[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | C683-0591 |
| Compound Name: | 2-(4-chlorophenyl)-7-methyl-4-(methylsulfanyl)-5H-[1]benzopyrano[2,3-d]pyrimidine |
| Molecular Weight: | 354.86 |
| Molecular Formula: | C19 H15 Cl N2 O S |
| Smiles: | Cc1ccc2c(Cc3c(nc(c4ccc(cc4)[Cl])nc3SC)O2)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.7248 |
| logD: | 6.7217 |
| logSw: | -6.5576 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.4022 |
| InChI Key: | OJYYHUVNGRXUOT-UHFFFAOYSA-N |