methyl 4-({5-(hydroxymethyl)-8-methyl-3-[(4-methylphenyl)carbamoyl]-2H-pyrano[2,3-c]pyridin-2-ylidene}amino)benzoate
Chemical Structure Depiction of
methyl 4-({5-(hydroxymethyl)-8-methyl-3-[(4-methylphenyl)carbamoyl]-2H-pyrano[2,3-c]pyridin-2-ylidene}amino)benzoate
methyl 4-({5-(hydroxymethyl)-8-methyl-3-[(4-methylphenyl)carbamoyl]-2H-pyrano[2,3-c]pyridin-2-ylidene}amino)benzoate
Compound characteristics
| Compound ID: | K227-0302 |
| Compound Name: | methyl 4-({5-(hydroxymethyl)-8-methyl-3-[(4-methylphenyl)carbamoyl]-2H-pyrano[2,3-c]pyridin-2-ylidene}amino)benzoate |
| Molecular Weight: | 457.49 |
| Molecular Formula: | C26 H23 N3 O5 |
| Smiles: | Cc1ccc(cc1)NC(C1=Cc2c(CO)cnc(C)c2OC/1=N/c1ccc(cc1)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6684 |
| logD: | 3.6683 |
| logSw: | -3.9311 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.724 |
| InChI Key: | MKUOYTOSTUVWJK-UHFFFAOYSA-N |