2-oxo-2-(2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)ethyl thiocyanate
Chemical Structure Depiction of
2-oxo-2-(2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)ethyl thiocyanate
2-oxo-2-(2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)ethyl thiocyanate
Compound characteristics
| Compound ID: | Y020-8188 |
| Compound Name: | 2-oxo-2-(2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)ethyl thiocyanate |
| Molecular Weight: | 274.38 |
| Molecular Formula: | C15 H18 N2 O S |
| Smiles: | CC1CC(C)(C)N(C(CSC#N)=O)c2ccccc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6522 |
| logD: | 2.6522 |
| logSw: | -3.0073 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.865 |
| InChI Key: | BUFYYHODUKCGCP-LLVKDONJSA-N |