2,2'-((4-((4-(4-Quinolinylamino)phenyl)methyl)phenyl)imino)bis-ethanol dihydrochloride
Basic information
- CAS
133041-49-3- Standard SMILES
Cl.Cl.OCCN(CCO)c1ccc(Cc2ccc(Nc3ccnc4ccccc34)cc2)cc1- InChIKey
FQKWUTMXACBJEL-UHFFFAOYSA-N- Molecular formula
- C26H29Cl2N3O2
- Average molar mass
- 486.4 g/mol
- Monoisotopic mass
- 485.1636826
Names & identifiers
- Preferred name
- 2,2'-((4-((4-(4-Quinolinylamino)phenyl)methyl)phenyl)imino)bis-ethanol dihydrochloride
- IUPAC
- 2-[N-(2-hydroxyethyl)-4-[[4-(quinolin-4-ylamino)phenyl]methyl]anilino]ethanol;dihydrochloride
- English name
- 2-[2-hydroxyethyl-[4-[[4-(quinolin-4-ylamino)phenyl]methyl]phenyl]amin o]ethanol dihydrochloride
- Molecular formula
- C26H29Cl2N3O2
- Molecular weight
- 0
Names & synonyms
133041-49-32,2'-((4-((4-(4-Quinolinylamino)phenyl)methyl)phenyl)imino)bis-ethanol dihydrochlorideDTXSID101579182-[N-(2-hydroxyethyl)-4-[[4-(quinolin-4-ylamino)phenyl]methyl]anilino]ethanol;dihydrochloride2-[2-hydroxyethyl-[4-[[4-(quinolin-4-ylamino)phenyl]methyl]phenyl]amin o]ethanol dihydrochloride2,2'-{[4-({4-[(Quinolin-4-yl)amino]phenyl}methyl)phenyl]azanediyl}di(ethan-1-ol)--hydrogen chloride (1/2)
Database identifiers
- CAS
133041-49-3- PubChem CID
- 149649
- DTXSID
DTXSID10157918
Properties
Computed structural properties
- Topological polar surface area
- 68.6 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 497
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Related reactions
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Compound notes
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