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1197230-74-2 | 2-Phenyl-3-piperazin-1-ylmethyl-imidazo[1,2-a]-pyridine oxalic acid salt
CAS No: 1197230-74-2 Catalog No: AG01F2G3 MDL No:
Product Description
Catalog Number:
AG01F2G3
Chemical Name:
2-Phenyl-3-piperazin-1-ylmethyl-imidazo[1,2-a]-pyridine oxalic acid salt
CAS Number:
1197230-74-2
Molecular Formula:
C20H22N4O4
Molecular Weight:
382.4131
IUPAC Name:
oxalic acid;2-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
InChI:
InChI=1S/C18H20N4.C2H2O4/c1-2-6-15(7-3-1)18-16(14-21-12-9-19-10-13-21)22-11-5-4-8-17(22)20-18;3-1(4)2(5)6/h1-8,11,19H,9-10,12-14H2;(H,3,4)(H,5,6)
InChI Key:
SITOTLBUHSTMKM-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)Cc1c(nc2n1cccc2)c1ccccc1.OC(=O)C(=O)O
Properties
Complexity:
421
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.164g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
382.42g/mol
Monoisotopic Mass:
382.164g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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