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Home> Hot Product Listed 2   > [2,5'-Bi-1H-benzimidazol]-5-amine,2'-(4-aminophenyl)-
199596-24-2 structure

[2,5'-Bi-1H-benzimidazol]-5-amine,2'-(4-aminophenyl)-

Iupac Name:5-chloro-N-[(Z)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine
CAS No.:199596-24-2
Molecular Weight:308.769
Molecular Formula:C28H20BRNO6S (isomer)
Names and Identifiers
Synonyms

2'-(4-aminophenyl)-[2,5'-bi-1h-benzimidazol]-5-amine 2'-(4-aminophenyl)-1h,1'h-2,5'-bibenzimidazol-5-amine 2'-(4-amino-phenyl)-3h,3'h-[2,5']bibenzoimidazolyl-5-ylamine 2-[2-(4-aminophenyl)-3h-1,3-benzodiazol-5-yl]-3h-1,3-benzodiazol-5-amine 2-[2-(4-aminophenyl)-3h-benzimidazol-5-yl]-3h-benzimidazol-5-amine 2-[2-(4-aminophenyl)benzimidazol-6-yl]benzimidazole-6-ylamine AB00074940-01 AC1LGN68 acm293762455 AG-690/09405007 AKOS000635167 AKOS001483260 B7043 BAS 03420670 BRD-K58299615-001-02-7 cambridge id 5180073 CBCHROMO1_000149 CBDIVE_006377 CCG-221974 CHEMBL578741 DTXSID80356431 gnf-pf-5510 HMS3262E21 MOLPORT-000-707-907 MOLPORT-001-662-696 MOLPORT-001-684-731 NCGC00094031-01 NCGC00094031-02 NCGC00094031-03 NCGC00094031-04 NCGC00094031-05 NCGC00094031-06 NCGC00261355-01 ro 90-7501, >=98% (hplc) Ro90-7501 RT-015428 SCHEMBL10002475 ST078196 STK367782 STOCK2S-20922 tox21_500670 ZINC18206988

Inchi
InChI=1S/C17H13ClN4/c18-14-9-10-16(20-12-14)21-22-17(13-6-2-1-3-7-13)15-8-4-5-11-19-15/h1-12H,(H,20,21)/b22-17-
InChkey
YHHFKWKMXWRVTJ-XLNRJJMWSA-N
Canonical Smiles
C1=CC=C(C=C1)C(=NNC2=NC=C(C=C2)Cl)C3=CC=CC=N3
Computational chemical data
  • Molecular Weight:308.769g/mol
  • Molecular Formula:C28H20BRNO6S
  • Compound Is Canonicalized:True
  • Exact Mass:308.083
  • Monoisotopic Mass:308.083
  • Complexity:368
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:50.2A^2
  • Heavy Atom Count:22
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:1
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADccB7gAAEAAAAAAAAAAAAAAAAAAAAAAA8WIAAAAAAAAAB8AAAHAIYAAAADArBHiQ9sJJqEACg AzZnZACShCkxByAc2CA4ZpiIIOLBk5HEIAhgmALIyCcQgMAOAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
 
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