methyl 4-(6-bromo-2-oxo-1,2,3,4-tetrahydrobenzo[h]quinolin-4-yl)benzoate
Chemical Structure Depiction of
methyl 4-(6-bromo-2-oxo-1,2,3,4-tetrahydrobenzo[h]quinolin-4-yl)benzoate
methyl 4-(6-bromo-2-oxo-1,2,3,4-tetrahydrobenzo[h]quinolin-4-yl)benzoate
Compound characteristics
Compound ID: | Y501-6746 |
Compound Name: | methyl 4-(6-bromo-2-oxo-1,2,3,4-tetrahydrobenzo[h]quinolin-4-yl)benzoate |
Molecular Weight: | 410.27 |
Molecular Formula: | C21 H16 Br N O3 |
Smiles: | COC(c1ccc(cc1)C1CC(Nc2c1cc(c1ccccc12)[Br])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.5289 |
logD: | 4.5288 |
logSw: | -4.4618 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 43.438 |
InChI Key: | JNZHJNVULVZWRQ-INIZCTEOSA-N |