N-[1-[6-[C-methyl-N-(pyridine-4-carbonylamino)carbonimidoyl]pyridin-2-yl]ethylideneamino]pyridine-4-carboxamide
Basic information
- CAS
147662-14-4- Standard SMILES
CC(=NNC(=O)c1ccncc1)c1cccc(C(C)=NNC(=O)c2ccncc2)n1- InChIKey
MYOXIVVMXFXRIM-UHFFFAOYSA-N- Molecular formula
- C21H19N7O2
- Average molar mass
- 401.4 g/mol
- Monoisotopic mass
- 401.16002287
Names & identifiers
- Preferred name
- N-[1-[6-[C-methyl-N-(pyridine-4-carbonylamino)carbonimidoyl]pyridin-2-yl]ethylideneamino]pyridine-4-carboxamide
- IUPAC
- N-[1-[6-[C-methyl-N-(pyridine-4-carbonylamino)carbonimidoyl]-2-pyridinyl]ethylideneamino]pyridine-4-carboxamide
Names & synonyms
147662-14-4N-[1-[6-[C-methyl-N-(pyridine-4-carbonylamino)carbonimidoyl]pyridin-2-yl]ethylideneamino]pyridine-4-carboxamideDTXSID40933181N-[1-(6-{1-[2-(Pyridine-4-carbonyl)hydrazinylidene]ethyl}pyridin-2-yl)ethylidene]pyridine-4-carbohydrazonic acid
Database identifiers
- CAS
147662-14-4- PubChem CID
- 391300
- DTXSID
DTXSID40933181
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 598
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Related reactions
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Compound notes
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