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871826-75-4

871826-75-4 | 1H-Indole, 3,3'-[(4-chlorophenyl)methylene]bis[5-bromo-

CAS No: 871826-75-4 Catalog No: AG004NL4 MDL No:

Product Description

Catalog Number:
AG004NL4
Chemical Name:
1H-Indole, 3,3'-[(4-chlorophenyl)methylene]bis[5-bromo-
CAS Number:
871826-75-4
Molecular Formula:
C23H15Br2ClN2
Molecular Weight:
514.6396
IUPAC Name:
5-bromo-3-[(5-bromo-1H-indol-3-yl)-(4-chlorophenyl)methyl]-1H-indole
InChI:
InChI=1S/C23H15Br2ClN2/c24-14-3-7-21-17(9-14)19(11-27-21)23(13-1-5-16(26)6-2-13)20-12-28-22-8-4-15(25)10-18(20)22/h1-12,23,27-28H
InChI Key:
PNKONBOGWPVFGH-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)C(c1c[nH]c2c1cc(Br)cc2)c1c[nH]c2c1cc(Br)cc2

Properties

Complexity:
505  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
513.927g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
514.645g/mol
Monoisotopic Mass:
511.929g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
31.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.6  

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