[4-{[(4-ethylphenyl)methyl]sulfanyl}-2-(2-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Chemical Structure Depiction of
[4-{[(4-ethylphenyl)methyl]sulfanyl}-2-(2-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
[4-{[(4-ethylphenyl)methyl]sulfanyl}-2-(2-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol
Compound characteristics
| Compound ID: | E544-0927 |
| Compound Name: | [4-{[(4-ethylphenyl)methyl]sulfanyl}-2-(2-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-6-yl]methanol |
| Molecular Weight: | 485.6 |
| Molecular Formula: | C28 H27 N3 O3 S |
| Smiles: | CCc1ccc(CSc2c3Cc4c(CO)cnc(C)c4Oc3nc(c3ccccc3OC)n2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1416 |
| logD: | 5.1387 |
| logSw: | -4.9452 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.275 |
| InChI Key: | IBBFLGNTKASSBT-UHFFFAOYSA-N |