200,000+ products from a single source!
sales@angenechem.com
728916-77-6 | 1-[6-Bromo-2-(4-fluoro-phenyl)-imidazo[1,2-a]-pyridin-3-ylmethyl]-piperidine-4-carboxylic acid
CAS No: 728916-77-6 Catalog No: AG01EX7H MDL No:
Product Description
Catalog Number:
AG01EX7H
Chemical Name:
1-[6-Bromo-2-(4-fluoro-phenyl)-imidazo[1,2-a]-pyridin-3-ylmethyl]-piperidine-4-carboxylic acid
CAS Number:
728916-77-6
Molecular Formula:
C20H19BrFN3O2
Molecular Weight:
432.2862
IUPAC Name:
1-[[6-bromo-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperidine-4-carboxylic acid
InChI:
InChI=1S/C20H19BrFN3O2/c21-15-3-6-18-23-19(13-1-4-16(22)5-2-13)17(25(18)11-15)12-24-9-7-14(8-10-24)20(26)27/h1-6,11,14H,7-10,12H2,(H,26,27)
InChI Key:
OFUYYLVRZZTOPW-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCN(CC1)Cc1c(nc2n1cc(Br)cc2)c1ccc(cc1)F
Properties
Complexity:
523
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
431.064g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
432.293g/mol
Monoisotopic Mass:
431.064g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.