2-amino-7,7-dimethyl-5-oxo-1-(pyridin-3-yl)-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-7,7-dimethyl-5-oxo-1-(pyridin-3-yl)-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-7,7-dimethyl-5-oxo-1-(pyridin-3-yl)-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | Y500-4879 |
| Compound Name: | 2-amino-7,7-dimethyl-5-oxo-1-(pyridin-3-yl)-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 376.48 |
| Molecular Formula: | C21 H20 N4 O S |
| Smiles: | CC1(C)CC2=C(C(C(C#N)=C(N)N2c2cccnc2)c2cccs2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3961 |
| logD: | 2.3961 |
| logSw: | -2.0694 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.913 |
| InChI Key: | ZFZFZUKJOKYBCA-SFHVURJKSA-N |