{3-[(4-bromo-3-methylphenyl)carbamoyl]-8-methyl-2-oxo-2H-pyrano[2,3-c]pyridin-5-yl}methyl propanoate
Chemical Structure Depiction of
{3-[(4-bromo-3-methylphenyl)carbamoyl]-8-methyl-2-oxo-2H-pyrano[2,3-c]pyridin-5-yl}methyl propanoate
{3-[(4-bromo-3-methylphenyl)carbamoyl]-8-methyl-2-oxo-2H-pyrano[2,3-c]pyridin-5-yl}methyl propanoate
Compound characteristics
| Compound ID: | G429-0162 |
| Compound Name: | {3-[(4-bromo-3-methylphenyl)carbamoyl]-8-methyl-2-oxo-2H-pyrano[2,3-c]pyridin-5-yl}methyl propanoate |
| Molecular Weight: | 459.29 |
| Molecular Formula: | C21 H19 Br N2 O5 |
| Smiles: | CCC(=O)OCc1cnc(C)c2c1C=C(C(Nc1ccc(c(C)c1)[Br])=O)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 3.9797 |
| logD: | 3.9691 |
| logSw: | -4.0746 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.184 |
| InChI Key: | RHQWQMCFQLUHEJ-UHFFFAOYSA-N |