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80348-51-2 | 1,4-Bis((2-methyl-5-nitro-1H-imidazol-1-yl)acetyl)piperazine
CAS No: 80348-51-2 Catalog No: AG00GML6 MDL No:
Product Description
Catalog Number:
AG00GML6
Chemical Name:
1,4-Bis((2-methyl-5-nitro-1H-imidazol-1-yl)acetyl)piperazine
CAS Number:
80348-51-2
IUPAC Name:
2-(2-methyl-5-nitroimidazol-1-yl)-1-[4-[2-(2-methyl-5-nitroimidazol-1-yl)acetyl]piperazin-1-yl]ethanone
InChI:
InChI=1S/C16H20N8O6/c1-11-17-7-13(23(27)28)21(11)9-15(25)19-3-5-20(6-4-19)16(26)10-22-12(2)18-8-14(22)24(29)30/h7-8H,3-6,9-10H2,1-2H3
InChI Key:
RJPXSUHQCWRNHC-UHFFFAOYSA-N
Properties
Complexity:
630
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
420.151g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
420.386g/mol
Monoisotopic Mass:
420.151g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
168A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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