200,000+ products from a single source!
sales@angenechem.com
21074-48-6 | Pyridinium, 4-(di-1H-indol-3-ylmethyl)-1-[3-(trimethylammonio)propyl]-, bromide (1:2)
CAS No: 21074-48-6 Catalog No: AG002KY5 MDL No:
Product Description
Catalog Number:
AG002KY5
Chemical Name:
Pyridinium, 4-(di-1H-indol-3-ylmethyl)-1-[3-(trimethylammonio)propyl]-, bromide (1:2)
CAS Number:
21074-48-6
Molecular Formula:
C28H32Br2N4
Molecular Weight:
584.3885
IUPAC Name:
3-[4-[bis(1H-indol-3-yl)methyl]pyridin-1-ium-1-yl]propyl-trimethylazanium;dibromide
InChI:
InChI=1S/C28H32N4.2BrH/c1-32(2,3)18-8-15-31-16-13-21(14-17-31)28(24-19-29-26-11-6-4-9-22(24)26)25-20-30-27-12-7-5-10-23(25)27;;/h4-7,9-14,16-17,19-20,28-30H,8,15,18H2,1-3H3;2*1H/q+2;;/p-2
InChI Key:
AXQLCHBHLBDYIF-UHFFFAOYSA-L
SMILES:
C[N+](CCC[n+]1ccc(cc1)C(c1c[nH]c2c1cccc2)c1c[nH]c2c1cccc2)(C)C.[Br-].[Br-]
Properties
Complexity:
561
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
584.097g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
584.4g/mol
Monoisotopic Mass:
582.099g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.