ethyl 4-({4-[cyclopentyl(methyl)amino]piperidine-1-carbothioyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({4-[cyclopentyl(methyl)amino]piperidine-1-carbothioyl}amino)benzoate
ethyl 4-({4-[cyclopentyl(methyl)amino]piperidine-1-carbothioyl}amino)benzoate
Compound characteristics
| Compound ID: | K788-6466 |
| Compound Name: | ethyl 4-({4-[cyclopentyl(methyl)amino]piperidine-1-carbothioyl}amino)benzoate |
| Molecular Weight: | 389.56 |
| Molecular Formula: | C21 H31 N3 O2 S |
| Smiles: | CCOC(c1ccc(cc1)NC(N1CCC(CC1)N(C)C1CCCC1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7943 |
| logD: | 1.4684 |
| logSw: | -4.3919 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.904 |
| InChI Key: | IGEBWLJXEZYSEO-UHFFFAOYSA-N |