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Home > Other Heterocycles > 41944-72-3
41944-72-3 | 2,5-Piperazinedione,3,6-bis(1-azabicyclo[3.1.0]hex-2-yl)-
CAS No: 41944-72-3 Catalog No: AG00749Z MDL No:
Product Description
Catalog Number:
AG00749Z
Chemical Name:
2,5-Piperazinedione,3,6-bis(1-azabicyclo[3.1.0]hex-2-yl)-
CAS Number:
41944-72-3
Molecular Formula:
C14H20N4O2
Molecular Weight:
276.3342
IUPAC Name:
3,6-bis(1-azabicyclo[3.1.0]hexan-2-yl)piperazine-2,5-dione
InChI:
InChI=1S/C14H20N4O2/c19-13-11(9-3-1-7-5-17(7)9)15-14(20)12(16-13)10-4-2-8-6-18(8)10/h7-12H,1-6H2,(H,15,20)(H,16,19)
InChI Key:
XTYLMIUJPHXUPQ-UHFFFAOYSA-N
SMILES:
O=C1NC(C(=O)NC1C1CCC2N1C2)C1CCC2N1C2
NSC Number:
201424
Properties
Complexity:
452
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.159g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
276.34g/mol
Monoisotopic Mass:
276.159g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
6
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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