4-[(4-chloro-2,5-dimethoxyphenyl)diazenyl]-N-[4-[4-[[4-[(4-chloro-2,5-dimethoxyphenyl)diazenyl]-3-hydroxynaphthalene-2-carbonyl]amino]phenyl]phenyl]-3-hydroxynaphthalene-2-carboxamide
Basic information
- CAS
6166-65-0- Standard SMILES
COc1cc(N=Nc2c(O)c(C(=O)Nc3ccc(-c4ccc(NC(=O)c5cc6ccccc6c(N=Nc6cc(OC)c(Cl)cc6OC)c5O)cc4)cc3)cc3ccccc23)c(OC)cc1Cl- InChIKey
QZDNXXSKXULAEQ-UHFFFAOYSA-N- Molecular formula
- C50H38Cl2N6O8
- Average molar mass
- 921.8 g/mol
- Monoisotopic mass
- 920.2128176
Names & identifiers
- Preferred name
- 4-[(4-chloro-2,5-dimethoxyphenyl)diazenyl]-N-[4-[4-[[4-[(4-chloro-2,5-dimethoxyphenyl)diazenyl]-3-hydroxynaphthalene-2-carbonyl]amino]phenyl]phenyl]-3-hydroxynaphthalene-2-carboxamide
- IUPAC
- 4-[(4-chloro-2,5-dimethoxyphenyl)diazenyl]-N-[4-[4-[[4-[(4-chloro-2,5-dimethoxyphenyl)diazenyl]-3-hydroxynaphthalene-2-carbonyl]amino]phenyl]phenyl]-3-hydroxynaphthalene-2-carboxamide
Names & synonyms
DTXSID0011091086166-65-02-Naphthalenecarboxamide, N,Na(2)-[1,1a(2)-biphenyl]-4,4a(2)-diylbis[4-[(4-chloro-2,5-dimethoxyphenyl)azo]-3-hydroxy-
Database identifiers
- CAS
6166-65-0- PubChem CID
- 165367476
- DTXSID
DTXSID001109108- EC Number
- 612-187-1
Properties
Computed structural properties
- XLogP
- 12.8
- Topological polar surface area
- 185 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 13
- Heavy atoms
- 66
- Formal charge
- 0
- Complexity
- 1,520
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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