tert-butyl {[3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
tert-butyl {[3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetate
tert-butyl {[3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | 8003-4608 |
| Compound Name: | tert-butyl {[3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 386.53 |
| Molecular Formula: | C20 H22 N2 O2 S2 |
| Smiles: | CC(C)(C)OC(CSc1c(C#N)c(c2CCCCc2n1)c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5658 |
| logD: | 5.5657 |
| logSw: | -5.3316 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.478 |
| InChI Key: | TUZFOZXNYNZNKE-UHFFFAOYSA-N |