diethyl 5-amino-7-(3-nitrophenyl)-2-[(3-nitrophenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
Chemical Structure Depiction of
diethyl 5-amino-7-(3-nitrophenyl)-2-[(3-nitrophenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
diethyl 5-amino-7-(3-nitrophenyl)-2-[(3-nitrophenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
Compound characteristics
| Compound ID: | 2435-0157 |
| Compound Name: | diethyl 5-amino-7-(3-nitrophenyl)-2-[(3-nitrophenyl)methylidene]-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate |
| Molecular Weight: | 566.55 |
| Molecular Formula: | C26 H22 N4 O9 S |
| Smiles: | CCOC(C1C(C(=C2N(C=1N)C(/C(=C/c1cccc(c1)[N+]([O-])=O)S2)=O)C(=O)OCC)c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0638 |
| logD: | 4.0638 |
| logSw: | -4.2419 |
| Hydrogen bond acceptors count: | 17 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 144.56 |
| InChI Key: | NEMROETYZCNIPI-IBGZPJMESA-N |