diethyl 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
| Molecular Formula | C19H21N3O5 |
|---|---|
| Molecular Weight | 371.4 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 104.0 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 371.14813 |
| Heavy Atoms | 27 |
| Complexity | 632.0 |
Chemical Identifiers
| CAS Number | 72803-02-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C(C1C2=CC=CC3=NON=C32)C(=O)OCC)C)C |
| InChIKey | QERUYFVNIOLCHV-UHFFFAOYSA-N |
📖 Product Overview
diethyl 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate (CAS: 72803-02-2) is a chemical compound with molecular formula C19H21N3O5 and molecular weight 371.4 g/mol. Its IUPAC systematic name is diethyl 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate.
QERUYFVNIOLCHV-UHFFFAOYSA-N.
SMILES: CCOC(=O)C1=C(NC(=C(C1C2=CC=CC3=NON=C32)C(=O)OCC)C)C.
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