Basic information
- Standard SMILES
O=C(CCl)N=c1ccccn1Cc1ccc(Cl)nc1- InChIKey
UQFPRXOFZHFZAK-UHFFFAOYSA-N- Molecular formula
- C13H11Cl2N3O
- Average molar mass
- 296.15 g/mol
- Monoisotopic mass
- 295.0279174
Names & identifiers
- Preferred name
- 2-chloro-N-[1-((6-chloropyridin-3-yl)methyl)pyridin-2(1H)-ylidene]-acetamide
- IUPAC
- 2-chloro-N-[1-[(6-chloro-3-pyridinyl)methyl]-2-pyridinylidene]acetamide
Names & synonyms
SCHEMBL15009730SCHEMBL15009733SCHEMBL29596579UQFPRXOFZHFZAK-UHFFFAOYSA-N2-chloro-N-[1-((6-chloropyridin-3-yl)methyl)pyridin-2(1H)-ylidene]-acetamide
Database identifiers
- PubChem CID
- 89613241
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 45.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 420
Related reactions
1 records
Compound notes
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