1-(4-bromo-2-chlorophenyl)-7,7-dimethyl-4-(pyridin-3-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Chemical Structure Depiction of
1-(4-bromo-2-chlorophenyl)-7,7-dimethyl-4-(pyridin-3-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
1-(4-bromo-2-chlorophenyl)-7,7-dimethyl-4-(pyridin-3-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Compound characteristics
| Compound ID: | 8015-2258 |
| Compound Name: | 1-(4-bromo-2-chlorophenyl)-7,7-dimethyl-4-(pyridin-3-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione |
| Molecular Weight: | 459.77 |
| Molecular Formula: | C22 H20 Br Cl N2 O2 |
| Smiles: | CC1(C)CC2=C(C(CC(N2c2ccc(cc2[Cl])[Br])=O)c2cccnc2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9917 |
| logD: | 3.9908 |
| logSw: | -4.3663 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.803 |
| InChI Key: | GFDSTBDXBOHDKR-OAHLLOKOSA-N |