ethyl 4-({4-[cyclohexyl(methyl)amino]piperidine-1-carbothioyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({4-[cyclohexyl(methyl)amino]piperidine-1-carbothioyl}amino)benzoate
ethyl 4-({4-[cyclohexyl(methyl)amino]piperidine-1-carbothioyl}amino)benzoate
Compound characteristics
| Compound ID: | K788-6503 |
| Compound Name: | ethyl 4-({4-[cyclohexyl(methyl)amino]piperidine-1-carbothioyl}amino)benzoate |
| Molecular Weight: | 403.59 |
| Molecular Formula: | C22 H33 N3 O2 S |
| Smiles: | CCOC(c1ccc(cc1)NC(N1CCC(CC1)N(C)C1CCCCC1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2854 |
| logD: | 2.214 |
| logSw: | -5.0745 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.538 |
| InChI Key: | PKPITBLYAOUYFE-UHFFFAOYSA-N |