[4-{[(2,5-dimethylphenyl)methyl]sulfanyl}-9-methyl-2-(2-methylphenyl)-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Chemical Structure Depiction of
[4-{[(2,5-dimethylphenyl)methyl]sulfanyl}-9-methyl-2-(2-methylphenyl)-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
[4-{[(2,5-dimethylphenyl)methyl]sulfanyl}-9-methyl-2-(2-methylphenyl)-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Compound characteristics
Compound ID: | E544-0756 |
Compound Name: | [4-{[(2,5-dimethylphenyl)methyl]sulfanyl}-9-methyl-2-(2-methylphenyl)-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol |
Molecular Weight: | 469.61 |
Molecular Formula: | C28 H27 N3 O2 S |
Smiles: | Cc1ccc(C)c(CSc2c3Cc4c(CO)cnc(C)c4Oc3nc(c3ccccc3C)n2)c1 |
Stereo: | ACHIRAL |
logP: | 6.2002 |
logD: | 6.1974 |
logSw: | -5.5114 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 52.644 |
InChI Key: | PBQSXHRLJIXRAG-UHFFFAOYSA-N |