2-amino-1-(4-chlorophenyl)-4-{2,4-dimethyl-5-[(morpholin-4-yl)methyl]phenyl}-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-1-(4-chlorophenyl)-4-{2,4-dimethyl-5-[(morpholin-4-yl)methyl]phenyl}-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-1-(4-chlorophenyl)-4-{2,4-dimethyl-5-[(morpholin-4-yl)methyl]phenyl}-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8020-4582 |
| Compound Name: | 2-amino-1-(4-chlorophenyl)-4-{2,4-dimethyl-5-[(morpholin-4-yl)methyl]phenyl}-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 531.1 |
| Molecular Formula: | C31 H35 Cl N4 O2 |
| Smiles: | Cc1cc(C)c(cc1CN1CCOCC1)C1C(C#N)=C(N)N(C2CC(C)(C)CC(C1=2)=O)c1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.901 |
| logD: | 4.7726 |
| logSw: | -4.849 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.018 |
| InChI Key: | IHMWFSMZXBWBEW-NDEPHWFRSA-N |