dimethyl 2-{[4-(furan-2-carbonyl)piperazine-1-carbothioyl]amino}benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-{[4-(furan-2-carbonyl)piperazine-1-carbothioyl]amino}benzene-1,4-dicarboxylate
dimethyl 2-{[4-(furan-2-carbonyl)piperazine-1-carbothioyl]amino}benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | C200-1762 |
| Compound Name: | dimethyl 2-{[4-(furan-2-carbonyl)piperazine-1-carbothioyl]amino}benzene-1,4-dicarboxylate |
| Molecular Weight: | 431.47 |
| Molecular Formula: | C20 H21 N3 O6 S |
| Smiles: | COC(c1ccc(C(=O)OC)c(c1)NC(N1CCN(CC1)C(c1ccco1)=O)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5927 |
| logD: | 2.5924 |
| logSw: | -3.1861 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.821 |
| InChI Key: | GLZCVTIBEVRRPD-UHFFFAOYSA-N |