propyl [(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
propyl [(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetate
propyl [(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 4554-6483 |
| Compound Name: | propyl [(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetate |
| Molecular Weight: | 304.37 |
| Molecular Formula: | C15 H16 N2 O3 S |
| Smiles: | CCCOC(CSc1c(C#N)cc2C(CCCc2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8723 |
| logD: | 2.8723 |
| logSw: | -3.1468 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.164 |
| InChI Key: | HYMRIBBVXUJARO-UHFFFAOYSA-N |