2-amino-1-(3-chlorophenyl)-4-{4-[(morpholin-4-yl)methyl]thiophen-2-yl}-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-1-(3-chlorophenyl)-4-{4-[(morpholin-4-yl)methyl]thiophen-2-yl}-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-1-(3-chlorophenyl)-4-{4-[(morpholin-4-yl)methyl]thiophen-2-yl}-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8017-0154 |
| Compound Name: | 2-amino-1-(3-chlorophenyl)-4-{4-[(morpholin-4-yl)methyl]thiophen-2-yl}-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 481.02 |
| Molecular Formula: | C25 H25 Cl N4 O2 S |
| Smiles: | C1CC2=C(C(C(C#N)=C(N)N2c2cccc(c2)[Cl])c2cc(CN3CCOCC3)cs2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0048 |
| logD: | 2.1109 |
| logSw: | -3.4657 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.036 |
| InChI Key: | QAGRJTDLZJKHQU-HSZRJFAPSA-N |