2-{[2-(4-fluorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[2-(4-fluorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
2-{[2-(4-fluorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | E544-0376 |
| Compound Name: | 2-{[2-(4-fluorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide |
| Molecular Weight: | 518.57 |
| Molecular Formula: | C27 H23 F N4 O4 S |
| Smiles: | Cc1c2c(Cc3c(nc(c4ccc(cc4)F)nc3SCC(Nc3cccc(c3)OC)=O)O2)c(CO)cn1 |
| Stereo: | ACHIRAL |
| logP: | 5.0233 |
| logD: | 5.0204 |
| logSw: | -4.7306 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.338 |
| InChI Key: | IARVTIYUJMDGFZ-UHFFFAOYSA-N |