dimethyl 7-(4-methoxyphenyl)-2,12-dioxo-6,8-dithia-3,11-diazatridecane-4,10-dicarboxylate
Chemical Structure Depiction of
dimethyl 7-(4-methoxyphenyl)-2,12-dioxo-6,8-dithia-3,11-diazatridecane-4,10-dicarboxylate
dimethyl 7-(4-methoxyphenyl)-2,12-dioxo-6,8-dithia-3,11-diazatridecane-4,10-dicarboxylate
Compound characteristics
| Compound ID: | C700-1277 |
| Compound Name: | dimethyl 7-(4-methoxyphenyl)-2,12-dioxo-6,8-dithia-3,11-diazatridecane-4,10-dicarboxylate |
| Molecular Weight: | 472.58 |
| Molecular Formula: | C20 H28 N2 O7 S2 |
| Smiles: | CC(NC(CSC(c1ccc(cc1)OC)SCC(C(=O)OC)NC(C)=O)C(=O)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.7175 |
| logD: | 0.7174 |
| logSw: | -1.7498 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.559 |
| InChI Key: | DRHOMILWMUSOFS-UHFFFAOYSA-N |