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77917-22-7

77917-22-7 | 2,3-Piperazinedione, 1-((4-nitrophenyl)methyl)-4-((4-(2-pyrimidinylami no)phenyl)methyl)-

CAS No: 77917-22-7 Catalog No: AG00GGV7 MDL No:

Product Description

Catalog Number:
AG00GGV7
Chemical Name:
2,3-Piperazinedione, 1-((4-nitrophenyl)methyl)-4-((4-(2-pyrimidinylami no)phenyl)methyl)-
CAS Number:
77917-22-7
IUPAC Name:
1-[(4-nitrophenyl)methyl]-4-[[4-(pyrimidin-2-ylamino)phenyl]methyl]piperazine-2,3-dione
InChI:
InChI=1S/C22H20N6O4/c29-20-21(30)27(15-17-4-8-19(9-5-17)28(31)32)13-12-26(20)14-16-2-6-18(7-3-16)25-22-23-10-1-11-24-22/h1-11H,12-15H2,(H,23,24,25)
InChI Key:
JJJKZKRFLJXTQH-UHFFFAOYSA-N

Properties

Complexity:
664  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
432.155g/mol
Formal Charge:
0
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
432.44g/mol
Monoisotopic Mass:
432.155g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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