{2-[(3-chloro-4-fluorophenyl)imino]-8-methyl-3-[(4-methylphenyl)carbamoyl]-2H-pyrano[2,3-c]pyridin-5-yl}methyl acetate
Chemical Structure Depiction of
{2-[(3-chloro-4-fluorophenyl)imino]-8-methyl-3-[(4-methylphenyl)carbamoyl]-2H-pyrano[2,3-c]pyridin-5-yl}methyl acetate
{2-[(3-chloro-4-fluorophenyl)imino]-8-methyl-3-[(4-methylphenyl)carbamoyl]-2H-pyrano[2,3-c]pyridin-5-yl}methyl acetate
Compound characteristics
| Compound ID: | K227-0321 |
| Compound Name: | {2-[(3-chloro-4-fluorophenyl)imino]-8-methyl-3-[(4-methylphenyl)carbamoyl]-2H-pyrano[2,3-c]pyridin-5-yl}methyl acetate |
| Molecular Weight: | 493.92 |
| Molecular Formula: | C26 H21 Cl F N3 O4 |
| Smiles: | CC(=O)OCc1cnc(C)c2c1C=C(/C(=N/c1ccc(c(c1)[Cl])F)O2)C(Nc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.914 |
| logD: | 4.9139 |
| logSw: | -4.9866 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.666 |
| InChI Key: | ZSUKWZINBCHPAD-UHFFFAOYSA-N |