2-methyl-5-oxo-4,7-diphenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-methyl-5-oxo-4,7-diphenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-methyl-5-oxo-4,7-diphenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8009-5729 |
| Compound Name: | 2-methyl-5-oxo-4,7-diphenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 340.42 |
| Molecular Formula: | C23 H20 N2 O |
| Smiles: | CC1=C(C#N)C(C2=C(CC(CC2=O)c2ccccc2)N1)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4445 |
| logD: | 1.3507 |
| logSw: | -4.3307 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.706 |
| InChI Key: | CKPJRAQYBABQRJ-UHFFFAOYSA-N |