[2-(2-chlorophenyl)-4-(ethylsulfanyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Chemical Structure Depiction of
[2-(2-chlorophenyl)-4-(ethylsulfanyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
[2-(2-chlorophenyl)-4-(ethylsulfanyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Compound characteristics
Compound ID: | E544-0182 |
Compound Name: | [2-(2-chlorophenyl)-4-(ethylsulfanyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol |
Molecular Weight: | 399.9 |
Molecular Formula: | C20 H18 Cl N3 O2 S |
Smiles: | CCSc1c2Cc3c(CO)cnc(C)c3Oc2nc(c2ccccc2[Cl])n1 |
Stereo: | ACHIRAL |
logP: | 4.0799 |
logD: | 4.077 |
logSw: | -4.2262 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 52.916 |
InChI Key: | JOMPGINKXSHBGJ-UHFFFAOYSA-N |