ethyl 4-({4-[methyl(propan-2-yl)amino]piperidine-1-carbothioyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({4-[methyl(propan-2-yl)amino]piperidine-1-carbothioyl}amino)benzoate
ethyl 4-({4-[methyl(propan-2-yl)amino]piperidine-1-carbothioyl}amino)benzoate
Compound characteristics
| Compound ID: | K784-8471 |
| Compound Name: | ethyl 4-({4-[methyl(propan-2-yl)amino]piperidine-1-carbothioyl}amino)benzoate |
| Molecular Weight: | 363.52 |
| Molecular Formula: | C19 H29 N3 O2 S |
| Smiles: | CCOC(c1ccc(cc1)NC(N1CCC(CC1)N(C)C(C)C)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3745 |
| logD: | 0.898 |
| logSw: | -4.0768 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.308 |
| InChI Key: | QSWCVSGVNKNHAR-UHFFFAOYSA-N |