dimethyl 2-[(4'-carbamoyl[1,4'-bipiperidine]-1'-carbothioyl)amino]benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-[(4'-carbamoyl[1,4'-bipiperidine]-1'-carbothioyl)amino]benzene-1,4-dicarboxylate
dimethyl 2-[(4'-carbamoyl[1,4'-bipiperidine]-1'-carbothioyl)amino]benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | C200-1772 |
| Compound Name: | dimethyl 2-[(4'-carbamoyl[1,4'-bipiperidine]-1'-carbothioyl)amino]benzene-1,4-dicarboxylate |
| Molecular Weight: | 462.57 |
| Molecular Formula: | C22 H30 N4 O5 S |
| Smiles: | COC(c1ccc(C(=O)OC)c(c1)NC(N1CCC(CC1)(C(N)=O)N1CCCCC1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8751 |
| logD: | 2.0637 |
| logSw: | -3.4538 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.922 |
| InChI Key: | CNEDVJAJUANQSQ-UHFFFAOYSA-N |