methyl 4-({2-[(3-fluoro-4-methylphenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 4-({2-[(3-fluoro-4-methylphenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbonyl}amino)benzoate
methyl 4-({2-[(3-fluoro-4-methylphenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | K227-0430 |
| Compound Name: | methyl 4-({2-[(3-fluoro-4-methylphenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbonyl}amino)benzoate |
| Molecular Weight: | 475.48 |
| Molecular Formula: | C26 H22 F N3 O5 |
| Smiles: | Cc1ccc(cc1F)/N=C1/C(=Cc2c(CO)cnc(C)c2O1)C(Nc1ccc(cc1)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.086 |
| logD: | 4.0852 |
| logSw: | -4.2975 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.724 |
| InChI Key: | FPLNAFFRCYEPGB-UHFFFAOYSA-N |