dimethyl 2-{[benzyl(2-phenylethyl)carbamothioyl]amino}benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-{[benzyl(2-phenylethyl)carbamothioyl]amino}benzene-1,4-dicarboxylate
dimethyl 2-{[benzyl(2-phenylethyl)carbamothioyl]amino}benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | C200-1700 |
| Compound Name: | dimethyl 2-{[benzyl(2-phenylethyl)carbamothioyl]amino}benzene-1,4-dicarboxylate |
| Molecular Weight: | 462.57 |
| Molecular Formula: | C26 H26 N2 O4 S |
| Smiles: | COC(c1ccc(C(=O)OC)c(c1)NC(N(CCc1ccccc1)Cc1ccccc1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5434 |
| logD: | 5.5429 |
| logSw: | -5.459 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.056 |
| InChI Key: | ONAVGQXTMOSQST-UHFFFAOYSA-N |