dimethyl 2-{[4-(4-methoxyphenyl)piperazine-1-carbothioyl]amino}benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-{[4-(4-methoxyphenyl)piperazine-1-carbothioyl]amino}benzene-1,4-dicarboxylate
dimethyl 2-{[4-(4-methoxyphenyl)piperazine-1-carbothioyl]amino}benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | C200-1644 |
| Compound Name: | dimethyl 2-{[4-(4-methoxyphenyl)piperazine-1-carbothioyl]amino}benzene-1,4-dicarboxylate |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C22 H25 N3 O5 S |
| Smiles: | COC(c1ccc(C(=O)OC)c(c1)NC(N1CCN(CC1)c1ccc(cc1)OC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1238 |
| logD: | 4.1097 |
| logSw: | -4.2182 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.591 |
| InChI Key: | VMOJMFYHVRTLGK-UHFFFAOYSA-N |