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Home > Imidazoles > 817172-55-7
817172-55-7 | 7-Methyl-2-(4-nitro-phenyl)-3-piperazin-1-ylmethyl-imidazo[1,2-a!pyridine
CAS No: 817172-55-7 Catalog No: AG01EXIX MDL No:
Product Description
Catalog Number:
AG01EXIX
Chemical Name:
7-Methyl-2-(4-nitro-phenyl)-3-piperazin-1-ylmethyl-imidazo[1,2-a!pyridine
CAS Number:
817172-55-7
Molecular Formula:
C19H21N5O2
Molecular Weight:
351.4023
IUPAC Name:
7-methyl-2-(4-nitrophenyl)-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
InChI:
InChI=1S/C19H21N5O2/c1-14-6-9-23-17(13-22-10-7-20-8-11-22)19(21-18(23)12-14)15-2-4-16(5-3-15)24(25)26/h2-6,9,12,20H,7-8,10-11,13H2,1H3
InChI Key:
XYECQJQLXVFFEE-UHFFFAOYSA-N
SMILES:
Cc1ccn2c(c1)nc(c2CN1CCNCC1)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
485
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.17g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
351.41g/mol
Monoisotopic Mass:
351.17g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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