diethyl 2-(3,5-dinitrobenzamido)-4,7-dihydrothieno[2,3-c]pyridine-3,6(5H)-dicarboxylate
Chemical Structure Depiction of
diethyl 2-(3,5-dinitrobenzamido)-4,7-dihydrothieno[2,3-c]pyridine-3,6(5H)-dicarboxylate
diethyl 2-(3,5-dinitrobenzamido)-4,7-dihydrothieno[2,3-c]pyridine-3,6(5H)-dicarboxylate
Compound characteristics
| Compound ID: | 3261-0140 |
| Compound Name: | diethyl 2-(3,5-dinitrobenzamido)-4,7-dihydrothieno[2,3-c]pyridine-3,6(5H)-dicarboxylate |
| Molecular Weight: | 492.46 |
| Molecular Formula: | C20 H20 N4 O9 S |
| Smiles: | CCOC(c1c2CCN(Cc2sc1NC(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5178 |
| logD: | -2.68 |
| logSw: | -4.0757 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 133.275 |
| InChI Key: | OCSXYGVKFDHRER-UHFFFAOYSA-N |