2-[(4-cyanophenyl)imino]-5-(hydroxymethyl)-8-methyl-N-[3-(trifluoromethyl)phenyl]-2H-pyrano[2,3-c]pyridine-3-carboxamide
Chemical Structure Depiction of
2-[(4-cyanophenyl)imino]-5-(hydroxymethyl)-8-methyl-N-[3-(trifluoromethyl)phenyl]-2H-pyrano[2,3-c]pyridine-3-carboxamide
2-[(4-cyanophenyl)imino]-5-(hydroxymethyl)-8-methyl-N-[3-(trifluoromethyl)phenyl]-2H-pyrano[2,3-c]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | K227-0520 |
| Compound Name: | 2-[(4-cyanophenyl)imino]-5-(hydroxymethyl)-8-methyl-N-[3-(trifluoromethyl)phenyl]-2H-pyrano[2,3-c]pyridine-3-carboxamide |
| Molecular Weight: | 478.43 |
| Molecular Formula: | C25 H17 F3 N4 O3 |
| Smiles: | Cc1c2c(C=C(/C(=N/c3ccc(C#N)cc3)O2)C(Nc2cccc(c2)C(F)(F)F)=O)c(CO)cn1 |
| Stereo: | ACHIRAL |
| logP: | 3.8519 |
| logD: | 3.8479 |
| logSw: | -4.1175 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.606 |
| InChI Key: | MBECOZLFWYPMGI-UHFFFAOYSA-N |