2-Naphthalenecarboxamide, N-(4-(4-(1,1-dimethylpropyl)phenoxy)phenyl)-1-hydroxy-4-((4-methoxyphenyl)azo)-
Basic information
- CAS
88216-19-7- Standard SMILES
CCC(C)(C)c1ccc(Oc2ccc(NC(=O)c3cc(N=Nc4ccc(OC)cc4)c4ccccc4c3O)cc2)cc1- InChIKey
ZLFZSFPQCUTGBP-UHFFFAOYSA-N- Molecular formula
- C35H33N3O4
- Average molar mass
- 559.7 g/mol
- Monoisotopic mass
- 559.24710654
Names & identifiers
- Preferred name
- 2-Naphthalenecarboxamide, N-(4-(4-(1,1-dimethylpropyl)phenoxy)phenyl)-1-hydroxy-4-((4-methoxyphenyl)azo)-
- IUPAC
- 1-hydroxy-4-[(4-methoxyphenyl)diazenyl]-N-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]naphthalene-2-carboxamide
Names & synonyms
Component 3G-4M2-Naphthalenecarboxamide, N-(4-(4-(1,1-dimethylpropyl)phenoxy)phenyl)-1-hydroxy-4-((4-methoxyphenyl)azo)-88216-19-71-Hydroxy-2-naphthoic acid 4-(m'''-methoxyphenylazo)-p-(P''-tert-amylphenoxy)anilide
Database identifiers
- CAS
88216-19-7- PubChem CID
- 174672
Properties
Computed structural properties
- XLogP
- 9.7
- Topological polar surface area
- 92.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 871
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Compound notes
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