Simendan
2-[[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]hydrazinylidene]propanedinitrile
| Molecular Formula | C14H12N6O |
|---|---|
| Molecular Weight | 280.28 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 113.0 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.10727 |
| Heavy Atoms | 21 |
| Complexity | 549.0 |
Chemical Identifiers
| CAS Number | 131741-08-7 |
|---|---|
| SMILES | CC1CC(=O)NN=C1C2=CC=C(C=C2)NN=C(C#N)C#N |
| InChIKey | WHXMKTBCFHIYNQ-UHFFFAOYSA-N |
📖 Product Overview
Simendan (CAS: 131741-08-7) is a chemical compound with molecular formula C14H12N6O and molecular weight 280.28 g/mol. Its IUPAC systematic name is 2-[[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]hydrazinylidene]propanedinitrile.
WHXMKTBCFHIYNQ-UHFFFAOYSA-N.
SMILES: CC1CC(=O)NN=C1C2=CC=C(C=C2)NN=C(C#N)C#N.
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