Basic information
- CAS
477864-10-1- Standard SMILES
N/C(=N\OC(=O)c1ccc(=O)n(Cc2ccccc2)c1)c1ccccn1- InChIKey
DBCJQSDGEGTKFD-UHFFFAOYSA-N- Molecular formula
- C19H16N4O3
- Average molar mass
- 348.4 g/mol
- Monoisotopic mass
- 348.12224039
Names & identifiers
- Preferred name
- N'-{[(1-benzyl-6-oxo-1,6-dihydro-3-pyridinyl)carbonyl]oxy}-2-pyridinecarboximidamide
- IUPAC
- [(Z)-[amino(pyridin-2-yl)methylidene]amino] 1-benzyl-6-oxopyridine-3-carboxylate
Names & synonyms
477864-10-1N'-{[(1-benzyl-6-oxo-1,6-dihydro-3-pyridinyl)carbonyl]oxy}-2-pyridinecarboximidamide(Z)-[amino(pyridin-2-yl)methylidene]amino 1-benzyl-6-oxo-1,6-dihydropyridine-3-carboxylateMLS000721568CHEMBL1725799DTXSID201123522HMS2687K21AKOS00508125612P-578SSMR000335880(Imino-2-pyridinylmethyl)azanyl 1,6-dihydro-6-oxo-1-(phenylmethyl)-3-pyridinecarboxylate(Z)-[amino(pyridin-2-yl)methylidene]amino1-benzyl-6-oxo-1,6-dihydropyridine-3-carboxylate
Show more names
[(Z)-[amino(pyridin-2-yl)methylidene]amino] 1-benzyl-6-oxopyridine-3-carboxylateN-[(1-Benzyl-6-oxo-1,6-dihydropyridine-3-carbonyl)oxy]pyridine-2-carboximidamide
Database identifiers
- CAS
477864-10-1- PubChem CID
- 9634331
- DTXSID
DTXSID201123522- ChEMBL
CHEMBL1725799
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 97.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 620
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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