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Home Other Building Blocks Pyrrolo[1,2-a]pyrazin-1(2H)-one, hexahydro-

Pyrrolo[1,2-a]pyrazin-1(2H)-one, hexahydro-

CAS No.:
16620-61-4
Catalog Number:
AG001WL2
Molecular Formula:
C7H12N2O
Molecular Weight:
140.1830
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Product Description
Catalog Number:
AG001WL2
Chemical Name:
Pyrrolo[1,2-a]pyrazin-1(2H)-one, hexahydro-
CAS Number:
16620-61-4
Molecular Formula:
C7H12N2O
Molecular Weight:
140.1830
MDL Number:
MFCD00601658
IUPAC Name:
3,4,6,7,8,8a-hexahydro-2H-pyrrolo[1,2-a]pyrazin-1-one
InChI:
InChI=1S/C7H12N2O/c10-7-6-2-1-4-9(6)5-3-8-7/h6H,1-5H2,(H,8,10)
InChI Key:
JBIHMFNMKHDTEE-UHFFFAOYSA-N
SMILES:
O=C1NCCN2C1CCC2
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.095g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
140.186g/mol
Monoisotopic Mass:
140.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^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
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties