[2-(2-chlorophenyl)-9-methyl-4-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Chemical Structure Depiction of
[2-(2-chlorophenyl)-9-methyl-4-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
[2-(2-chlorophenyl)-9-methyl-4-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Compound characteristics
| Compound ID: | C200-3235 |
| Compound Name: | [2-(2-chlorophenyl)-9-methyl-4-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol |
| Molecular Weight: | 504.05 |
| Molecular Formula: | C28 H26 Cl N3 O2 S |
| Smiles: | CC(C)c1ccc(CSc2c3Cc4c(CO)cnc(C)c4Oc3nc(c3ccccc3[Cl])n2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.1816 |
| logD: | 6.1787 |
| logSw: | -5.9248 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.644 |
| InChI Key: | IEDXFEQKVQYZHO-UHFFFAOYSA-N |