Methyl 2-[(2-carbamoylphenyl)amino]diazenylbenzoate
Basic information
- CAS
53017-94-0- Standard SMILES
COC(=O)c1ccccc1N=NNc1ccccc1C(N)=O- InChIKey
WDUPACPRQFPDQM-UHFFFAOYSA-N- Molecular formula
- C15H14N4O3
- Average molar mass
- 298.3 g/mol
- Monoisotopic mass
- 298.10659032
Names & identifiers
- Preferred name
- Methyl 2-[(2-carbamoylphenyl)amino]diazenylbenzoate
- IUPAC
- methyl 2-[(2-carbamoylanilino)diazenyl]benzoate
Names & synonyms
53017-94-0METHYL 2-[(2-CARBAMOYLPHENYL)AMINO]DIAZENYLBENZOATENSC284702DTXSID30314521NSC-284702DS-011408Methyl 2-[(1E)-3-(2-carbamoylphenyl)triaz-1-en-1-yl]benzoate
Database identifiers
- CAS
53017-94-0- PubChem CID
- 323573
- DTXSID
DTXSID30314521
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 427
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Compound notes
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