N-(4-bromophenyl)-1-(4-chlorophenyl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-1-(4-chlorophenyl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
N-(4-bromophenyl)-1-(4-chlorophenyl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | 5312-0069 |
| Compound Name: | N-(4-bromophenyl)-1-(4-chlorophenyl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide |
| Molecular Weight: | 499.79 |
| Molecular Formula: | C24 H20 Br Cl N2 O3 |
| Smiles: | CC1(C)CC2=C(C=C(C(Nc3ccc(cc3)[Br])=O)C(N2c2ccc(cc2)[Cl])=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9423 |
| logD: | 4.6772 |
| logSw: | -4.8675 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.671 |
| InChI Key: | BBJBRMCFPNHCME-UHFFFAOYSA-N |