sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 2,5-Piperazinedione, 3-(1-Methylethyl)-

2,5-Piperazinedione, 3-(1-Methylethyl)-

CAS No.:
14771-77-8
Catalog Number:
AG001F4V
Molecular Formula:
C7H12N2O2
Molecular Weight:
156.1824
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG001F4V
Chemical Name:
2,5-Piperazinedione, 3-(1-Methylethyl)-
CAS Number:
14771-77-8
Molecular Formula:
C7H12N2O2
Molecular Weight:
156.1824
MDL Number:
MFCD00480885
IUPAC Name:
3-propan-2-ylpiperazine-2,5-dione
InChI:
InChI=1S/C7H12N2O2/c1-4(2)6-7(11)8-3-5(10)9-6/h4,6H,3H2,1-2H3,(H,8,11)(H,9,10)
InChI Key:
IULFBTHVPRNQCG-UHFFFAOYSA-N
SMILES:
O=C1CNC(=O)C(N1)C(C)C
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.09g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
156.185g/mol
Monoisotopic Mass:
156.09g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties