ethyl 1-[(3,5-dimethylphenyl)carbamothioyl]piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[(3,5-dimethylphenyl)carbamothioyl]piperidine-3-carboxylate
ethyl 1-[(3,5-dimethylphenyl)carbamothioyl]piperidine-3-carboxylate
Compound characteristics
Compound ID: | Y600-1171 |
Compound Name: | ethyl 1-[(3,5-dimethylphenyl)carbamothioyl]piperidine-3-carboxylate |
Molecular Weight: | 320.45 |
Molecular Formula: | C17 H24 N2 O2 S |
Smiles: | CCOC(C1CCCN(C1)C(Nc1cc(C)cc(C)c1)=S)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.7712 |
logD: | 3.7712 |
logSw: | -3.8193 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 31.824 |
InChI Key: | VNHISLSKUFMGDN-AWEZNQCLSA-N |