(3-[(2,4-dimethoxyphenyl)carbamoyl]-8-methyl-2-{[4-(trifluoromethoxy)phenyl]imino}-2H-pyrano[2,3-c]pyridin-5-yl)methyl acetate
Chemical Structure Depiction of
(3-[(2,4-dimethoxyphenyl)carbamoyl]-8-methyl-2-{[4-(trifluoromethoxy)phenyl]imino}-2H-pyrano[2,3-c]pyridin-5-yl)methyl acetate
(3-[(2,4-dimethoxyphenyl)carbamoyl]-8-methyl-2-{[4-(trifluoromethoxy)phenyl]imino}-2H-pyrano[2,3-c]pyridin-5-yl)methyl acetate
Compound characteristics
| Compound ID: | K227-0486 |
| Compound Name: | (3-[(2,4-dimethoxyphenyl)carbamoyl]-8-methyl-2-{[4-(trifluoromethoxy)phenyl]imino}-2H-pyrano[2,3-c]pyridin-5-yl)methyl acetate |
| Molecular Weight: | 571.51 |
| Molecular Formula: | C28 H24 F3 N3 O7 |
| Smiles: | CC(=O)OCc1cnc(C)c2c1C=C(/C(=N/c1ccc(cc1)OC(F)(F)F)O2)C(Nc1ccc(cc1OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8505 |
| logD: | 4.8496 |
| logSw: | -4.6149 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.079 |
| InChI Key: | ZILCWSIXFKVUEP-UHFFFAOYSA-N |