5-(hydroxymethyl)-8-methyl-N-(2-methylphenyl)-2-{[3-(methylsulfanyl)phenyl]imino}-2H-pyrano[2,3-c]pyridine-3-carboxamide
Chemical Structure Depiction of
5-(hydroxymethyl)-8-methyl-N-(2-methylphenyl)-2-{[3-(methylsulfanyl)phenyl]imino}-2H-pyrano[2,3-c]pyridine-3-carboxamide
5-(hydroxymethyl)-8-methyl-N-(2-methylphenyl)-2-{[3-(methylsulfanyl)phenyl]imino}-2H-pyrano[2,3-c]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | K227-0897 |
| Compound Name: | 5-(hydroxymethyl)-8-methyl-N-(2-methylphenyl)-2-{[3-(methylsulfanyl)phenyl]imino}-2H-pyrano[2,3-c]pyridine-3-carboxamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C25 H23 N3 O3 S |
| Smiles: | Cc1ccccc1NC(C1=Cc2c(CO)cnc(C)c2OC/1=N/c1cccc(c1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7554 |
| logD: | 3.7554 |
| logSw: | -4.0521 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.852 |
| InChI Key: | XCDCBRBXTUNJGS-UHFFFAOYSA-N |