methyl 4-(2-bromophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 4-(2-bromophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
methyl 4-(2-bromophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 2716-4377 |
| Compound Name: | methyl 4-(2-bromophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 376.25 |
| Molecular Formula: | C18 H18 Br N O3 |
| Smiles: | CC1=C(C(C2=C(CCCC2=O)N1)c1ccccc1[Br])C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5415 |
| logD: | -0.1911 |
| logSw: | -3.6469 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.095 |
| InChI Key: | ONDGPJIPBLZDKC-INIZCTEOSA-N |