N-(2-chloro-4-methylphenyl)-5-(hydroxymethyl)-2-imino-8-methyl-2H-pyrano[2,3-c]pyridine-3-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-5-(hydroxymethyl)-2-imino-8-methyl-2H-pyrano[2,3-c]pyridine-3-carboxamide
N-(2-chloro-4-methylphenyl)-5-(hydroxymethyl)-2-imino-8-methyl-2H-pyrano[2,3-c]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | K227-0636 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-5-(hydroxymethyl)-2-imino-8-methyl-2H-pyrano[2,3-c]pyridine-3-carboxamide |
| Molecular Weight: | 357.79 |
| Molecular Formula: | C18 H16 Cl N3 O3 |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(C1=Cc2c(CO)cnc(C)c2OC1=N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3863 |
| logD: | 2.3802 |
| logSw: | -3.1944 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.383 |
| InChI Key: | NMPCIZSRTLPFKL-UHFFFAOYSA-N |