ethyl 1-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]piperidine-3-carboxylate
ethyl 1-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]piperidine-3-carboxylate
Compound characteristics
| Compound ID: | Y600-1177 |
| Compound Name: | ethyl 1-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]piperidine-3-carboxylate |
| Molecular Weight: | 386.9 |
| Molecular Formula: | C17 H23 Cl N2 O4 S |
| Smiles: | CCOC(C1CCCN(C1)C(Nc1cc(c(cc1OC)[Cl])OC)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7107 |
| logD: | 3.7105 |
| logSw: | -4.0583 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.387 |
| InChI Key: | ZCJPVMYNUDRXHT-NSHDSACASA-N |