5-(hydroxymethyl)-2-imino-8-methyl-N-[4-(trifluoromethoxy)phenyl]-2H-pyrano[2,3-c]pyridine-3-carboxamide
Chemical Structure Depiction of
5-(hydroxymethyl)-2-imino-8-methyl-N-[4-(trifluoromethoxy)phenyl]-2H-pyrano[2,3-c]pyridine-3-carboxamide
5-(hydroxymethyl)-2-imino-8-methyl-N-[4-(trifluoromethoxy)phenyl]-2H-pyrano[2,3-c]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | K227-0036 |
| Compound Name: | 5-(hydroxymethyl)-2-imino-8-methyl-N-[4-(trifluoromethoxy)phenyl]-2H-pyrano[2,3-c]pyridine-3-carboxamide |
| Molecular Weight: | 393.32 |
| Molecular Formula: | C18 H14 F3 N3 O4 |
| Smiles: | Cc1c2c(C=C(C(=N)O2)C(Nc2ccc(cc2)OC(F)(F)F)=O)c(CO)cn1 |
| Stereo: | ACHIRAL |
| logP: | 2.6555 |
| logD: | 2.6543 |
| logSw: | -3.0812 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.018 |
| InChI Key: | VUYSGXGIUFISNO-UHFFFAOYSA-N |