ethyl 1-[(3-chloro-4-fluorophenyl)carbamothioyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[(3-chloro-4-fluorophenyl)carbamothioyl]piperidine-4-carboxylate
ethyl 1-[(3-chloro-4-fluorophenyl)carbamothioyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | Y600-2446 |
| Compound Name: | ethyl 1-[(3-chloro-4-fluorophenyl)carbamothioyl]piperidine-4-carboxylate |
| Molecular Weight: | 344.83 |
| Molecular Formula: | C15 H18 Cl F N2 O2 S |
| Smiles: | CCOC(C1CCN(CC1)C(Nc1ccc(c(c1)[Cl])F)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8688 |
| logD: | 3.8687 |
| logSw: | -4.255 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.89 |
| InChI Key: | OLKUKQRLEBMRLT-UHFFFAOYSA-N |