methyl 4-({2-[(3,4-dimethylphenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 4-({2-[(3,4-dimethylphenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbonyl}amino)benzoate
methyl 4-({2-[(3,4-dimethylphenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | K227-0465 |
| Compound Name: | methyl 4-({2-[(3,4-dimethylphenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbonyl}amino)benzoate |
| Molecular Weight: | 471.51 |
| Molecular Formula: | C27 H25 N3 O5 |
| Smiles: | Cc1ccc(cc1C)/N=C1/C(=Cc2c(CO)cnc(C)c2O1)C(Nc1ccc(cc1)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5574 |
| logD: | 4.5565 |
| logSw: | -4.3556 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.724 |
| InChI Key: | WHZFGMKFUOGIPE-UHFFFAOYSA-N |