benzyl {[3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
benzyl {[3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetate
benzyl {[3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | 8003-4605 |
| Compound Name: | benzyl {[3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 420.55 |
| Molecular Formula: | C23 H20 N2 O2 S2 |
| Smiles: | C1CCc2c(C1)c(c(C#N)c(n2)SCC(=O)OCc1ccccc1)c1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 5.9106 |
| logD: | 5.9105 |
| logSw: | -5.823 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.473 |
| InChI Key: | ZEEKZKMSAKUJHX-UHFFFAOYSA-N |