N-(5-bromopyridin-2-yl)-7,7-dimethyl-2,5-dioxo-1-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Chemical Structure Depiction of
N-(5-bromopyridin-2-yl)-7,7-dimethyl-2,5-dioxo-1-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
N-(5-bromopyridin-2-yl)-7,7-dimethyl-2,5-dioxo-1-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | 6203-0065 |
| Compound Name: | N-(5-bromopyridin-2-yl)-7,7-dimethyl-2,5-dioxo-1-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide |
| Molecular Weight: | 466.33 |
| Molecular Formula: | C23 H20 Br N3 O3 |
| Smiles: | CC1(C)CC2=C(C=C(C(Nc3ccc(cn3)[Br])=O)C(N2c2ccccc2)=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9531 |
| logD: | 2.1151 |
| logSw: | -4.0959 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.376 |
| InChI Key: | OFFAGWFXLOKSPJ-UHFFFAOYSA-N |