Basic information
- CAS
548787-59-3- Standard SMILES
COc1ccc(C(=O)Nc2ccc(N=Nc3ccccc3)c(NC(=O)c3ccc(OC)c(OC)c3)c2)cc1OC- InChIKey
AHLXQKMNMNSBGF-UHFFFAOYSA-N- Molecular formula
- C30H28N4O6
- Average molar mass
- 540.6 g/mol
- Monoisotopic mass
- 540.20088463
Names & identifiers
- Preferred name
- Benzamide, N,N'-[4-(phenylazo)-1,3-phenylene]bis[3,4-dimethoxy-(9CI)
- IUPAC
- N-[3-[(3,4-dimethoxybenzoyl)amino]-4-phenyldiazenylphenyl]-3,4-dimethoxybenzamide
Names & synonyms
DTXSID101037609AKOS003884995548787-59-3Benzamide, N,N'-[4-(phenylazo)-1,3-phenylene]bis[3,4-dimethoxy- (9CI)
Database identifiers
- CAS
548787-59-3- PubChem CID
- 3539769
- DTXSID
DTXSID101037609
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 837
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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