(2-[(5-chloro-2-methoxyphenyl)imino]-8-methyl-3-{[3-(trifluoromethyl)phenyl]carbamoyl}-2H-pyrano[2,3-c]pyridin-5-yl)methyl acetate
Chemical Structure Depiction of
(2-[(5-chloro-2-methoxyphenyl)imino]-8-methyl-3-{[3-(trifluoromethyl)phenyl]carbamoyl}-2H-pyrano[2,3-c]pyridin-5-yl)methyl acetate
(2-[(5-chloro-2-methoxyphenyl)imino]-8-methyl-3-{[3-(trifluoromethyl)phenyl]carbamoyl}-2H-pyrano[2,3-c]pyridin-5-yl)methyl acetate
Compound characteristics
| Compound ID: | K227-0545 |
| Compound Name: | (2-[(5-chloro-2-methoxyphenyl)imino]-8-methyl-3-{[3-(trifluoromethyl)phenyl]carbamoyl}-2H-pyrano[2,3-c]pyridin-5-yl)methyl acetate |
| Molecular Weight: | 559.93 |
| Molecular Formula: | C27 H21 Cl F3 N3 O5 |
| Smiles: | CC(=O)OCc1cnc(C)c2c1C=C(/C(=N/c1cc(ccc1OC)[Cl])O2)C(Nc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.226 |
| logD: | 5.2219 |
| logSw: | -5.738 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.598 |
| InChI Key: | FSGVWRFTOWANMR-UHFFFAOYSA-N |