2-amino-4-(5-tert-butylthiophen-2-yl)-5-oxo-1-[(6-oxo-3-phenyl-1,6-dihydropyridazin-4-yl)amino]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(5-tert-butylthiophen-2-yl)-5-oxo-1-[(6-oxo-3-phenyl-1,6-dihydropyridazin-4-yl)amino]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-4-(5-tert-butylthiophen-2-yl)-5-oxo-1-[(6-oxo-3-phenyl-1,6-dihydropyridazin-4-yl)amino]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8017-9119 |
| Compound Name: | 2-amino-4-(5-tert-butylthiophen-2-yl)-5-oxo-1-[(6-oxo-3-phenyl-1,6-dihydropyridazin-4-yl)amino]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 512.63 |
| Molecular Formula: | C28 H28 N6 O2 S |
| Smiles: | CC(C)(C)c1ccc(C2C(C#N)=C(N)N(C3CCCC(C2=3)=O)NC2=CC(NN=C2c2ccccc2)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3109 |
| logD: | 3.4281 |
| logSw: | -4.4651 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 103.527 |
| InChI Key: | MASWFBFWSMFSCI-DEOSSOPVSA-N |