2-(4-chlorophenyl)-4-(ethylsulfanyl)-5H-[1]benzopyrano[2,3-d]pyrimidine
Chemical Structure Depiction of
2-(4-chlorophenyl)-4-(ethylsulfanyl)-5H-[1]benzopyrano[2,3-d]pyrimidine
2-(4-chlorophenyl)-4-(ethylsulfanyl)-5H-[1]benzopyrano[2,3-d]pyrimidine
Compound characteristics
Compound ID: | C683-0454 |
Compound Name: | 2-(4-chlorophenyl)-4-(ethylsulfanyl)-5H-[1]benzopyrano[2,3-d]pyrimidine |
Molecular Weight: | 354.86 |
Molecular Formula: | C19 H15 Cl N2 O S |
Smiles: | CCSc1c2Cc3ccccc3Oc2nc(c2ccc(cc2)[Cl])n1 |
Stereo: | ACHIRAL |
logP: | 6.8271 |
logD: | 6.824 |
logSw: | -6.6334 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 26.4022 |
InChI Key: | HPIPDHCNYKWLMH-UHFFFAOYSA-N |