2-amino-4-[4-(methylsulfanyl)phenyl]-5-oxo-6-phenyl-5,6-dihydro-4H-pyrano[3,2-c]quinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-[4-(methylsulfanyl)phenyl]-5-oxo-6-phenyl-5,6-dihydro-4H-pyrano[3,2-c]quinoline-3-carbonitrile
2-amino-4-[4-(methylsulfanyl)phenyl]-5-oxo-6-phenyl-5,6-dihydro-4H-pyrano[3,2-c]quinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8016-9426 |
| Compound Name: | 2-amino-4-[4-(methylsulfanyl)phenyl]-5-oxo-6-phenyl-5,6-dihydro-4H-pyrano[3,2-c]quinoline-3-carbonitrile |
| Molecular Weight: | 437.52 |
| Molecular Formula: | C26 H19 N3 O2 S |
| Smiles: | CSc1ccc(cc1)C1C(C#N)=C(N)OC2=C1C(N(c1ccccc1)c1ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3076 |
| logD: | 4.3076 |
| logSw: | -4.7296 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.269 |
| InChI Key: | ZENZMLLIJKPDMH-JOCHJYFZSA-N |