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681260-10-6 | 2-(4-Bromo-phenyl)-3-piperazin-1-ylmethyl-imidazo [1,2-a]pyridine
CAS No: 681260-10-6 Catalog No: AG01EWXG MDL No:
Product Description
Catalog Number:
AG01EWXG
Chemical Name:
2-(4-Bromo-phenyl)-3-piperazin-1-ylmethyl-imidazo [1,2-a]pyridine
CAS Number:
681260-10-6
Molecular Formula:
C18H19BrN4
Molecular Weight:
371.2743
IUPAC Name:
2-(4-bromophenyl)-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
InChI:
InChI=1S/C18H19BrN4/c19-15-6-4-14(5-7-15)18-16(13-22-11-8-20-9-12-22)23-10-2-1-3-17(23)21-18/h1-7,10,20H,8-9,11-13H2
InChI Key:
XCNAIIPASDTWSP-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)c1nc2n(c1CN1CCNCC1)cccc2
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.079g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
371.282g/mol
Monoisotopic Mass:
370.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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