ethyl 4-[(2-methoxyethyl){[3-(methylsulfanyl)phenyl]carbamothioyl}amino]piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[(2-methoxyethyl){[3-(methylsulfanyl)phenyl]carbamothioyl}amino]piperidine-1-carboxylate
ethyl 4-[(2-methoxyethyl){[3-(methylsulfanyl)phenyl]carbamothioyl}amino]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | K786-5335 |
| Compound Name: | ethyl 4-[(2-methoxyethyl){[3-(methylsulfanyl)phenyl]carbamothioyl}amino]piperidine-1-carboxylate |
| Molecular Weight: | 411.58 |
| Molecular Formula: | C19 H29 N3 O3 S2 |
| Smiles: | CCOC(N1CCC(CC1)N(CCOC)C(Nc1cccc(c1)SC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9107 |
| logD: | 3.9106 |
| logSw: | -3.8675 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.045 |
| InChI Key: | XTUJPNRWQIYSRM-UHFFFAOYSA-N |