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286949-66-4

286949-66-4 | 1H-Indole, 2-bromo-5,6-dichloro-

CAS No: 286949-66-4 Catalog No: AG002W47 MDL No:

Product Description

Catalog Number:
AG002W47
Chemical Name:
1H-Indole, 2-bromo-5,6-dichloro-
CAS Number:
286949-66-4
Molecular Formula:
C8H4BrCl2N
Molecular Weight:
264.9341
IUPAC Name:
2-bromo-5,6-dichloro-1H-indole
InChI:
InChI=1S/C8H4BrCl2N/c9-8-2-4-1-5(10)6(11)3-7(4)12-8/h1-3,12H
InChI Key:
DIELJODCLNAFKS-UHFFFAOYSA-N
SMILES:
Brc1[nH]c2c(c1)cc(c(c2)Cl)Cl

Properties

Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.89g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
264.931g/mol
Monoisotopic Mass:
262.89g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  

Literature

Title Journal
Synthesis and antiviral evaluation of trisubstituted indole N-nucleosides as analogues of 2,5,6-trichloro-1-(beta-D-ribofuranosyl)benzimidazole (TCRB). Journal of medicinal chemistry 20000615

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