Methyl 4-(2-{2-[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]hydrazinylidene}ethyl)benzoate
Basic information
- CAS
4529-63-9- Standard SMILES
COCc1cc(C)nc(NN=CCc2ccc(C(=O)OC)cc2)c1C#N- InChIKey
ZYJMNANYCBKROO-UHFFFAOYSA-N- Molecular formula
- C19H20N4O3
- Average molar mass
- 352.4 g/mol
- Monoisotopic mass
- 352.15354051
Names & identifiers
- Preferred name
- Methyl 4-(2-{2-[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]hydrazinylidene}ethyl)benzoate
- IUPAC
- methyl 4-[2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]hydrazinylidene]ethyl]benzoate
Names & synonyms
4529-63-9DTXSID70410354Methyl 4-(2-{2-[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]hydrazinylidene}ethyl)benzoate
Database identifiers
- CAS
4529-63-9- PubChem CID
- 5212445
- DTXSID
DTXSID70410354
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 96.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 522
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Related reactions
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Compound notes
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