N-(2,3-dimethylphenyl)-2-{[6-(hydroxymethyl)-2-(3-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,3-dimethylphenyl)-2-{[6-(hydroxymethyl)-2-(3-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
N-(2,3-dimethylphenyl)-2-{[6-(hydroxymethyl)-2-(3-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | E544-0099 |
| Compound Name: | N-(2,3-dimethylphenyl)-2-{[6-(hydroxymethyl)-2-(3-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 528.63 |
| Molecular Formula: | C29 H28 N4 O4 S |
| Smiles: | Cc1cccc(c1C)NC(CSc1c2Cc3c(CO)cnc(C)c3Oc2nc(c2cccc(c2)OC)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6187 |
| logD: | 5.6158 |
| logSw: | -5.3637 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.64 |
| InChI Key: | QXWIOVIWKGRLPS-UHFFFAOYSA-N |