5-oxo-2-[(prop-2-en-1-yl)sulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
5-oxo-2-[(prop-2-en-1-yl)sulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
5-oxo-2-[(prop-2-en-1-yl)sulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | D360-7058 |
| Compound Name: | 5-oxo-2-[(prop-2-en-1-yl)sulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile |
| Molecular Weight: | 244.31 |
| Molecular Formula: | C13 H12 N2 O S |
| Smiles: | C=CCSc1c(C#N)cc2C(CCCc2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0682 |
| logD: | 3.0682 |
| logSw: | -3.3912 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.711 |
| InChI Key: | IEJOAAOMYGYXNO-UHFFFAOYSA-N |