2-amino-4-{4-[(morpholin-4-yl)methyl]thiophen-2-yl}-5-oxo-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-{4-[(morpholin-4-yl)methyl]thiophen-2-yl}-5-oxo-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-4-{4-[(morpholin-4-yl)methyl]thiophen-2-yl}-5-oxo-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8016-8937 |
| Compound Name: | 2-amino-4-{4-[(morpholin-4-yl)methyl]thiophen-2-yl}-5-oxo-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 514.57 |
| Molecular Formula: | C26 H25 F3 N4 O2 S |
| Smiles: | C1CC2=C(C(C(C#N)=C(N)N2c2ccccc2C(F)(F)F)c2cc(CN3CCOCC3)cs2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.27 |
| logD: | 2.3761 |
| logSw: | -3.7531 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.735 |
| InChI Key: | JGPGKWAERFNHBN-QHCPKHFHSA-N |