Home Other Building Blocks 1,3,4-Oxadiazole-2(3H)-thione, 5-cyclopropyl-

1,3,4-Oxadiazole-2(3H)-thione, 5-cyclopropyl-

CAS No.:
64007-54-1
Catalog Number:
AG019HC7
Molecular Formula:
C5H6N2OS
Molecular Weight:
142.1789
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG019HC7
Chemical Name:
1,3,4-Oxadiazole-2(3H)-thione, 5-cyclopropyl-
CAS Number:
64007-54-1
Molecular Formula:
C5H6N2OS
Molecular Weight:
142.1789
MDL Number:
MFCD06673128
IUPAC Name:
5-cyclopropyl-3H-1,3,4-oxadiazole-2-thione
InChI:
InChI=1S/C5H6N2OS/c9-5-7-6-4(8-5)3-1-2-3/h3H,1-2H2,(H,7,9)
InChI Key:
MOBWRVHKGDLTHD-UHFFFAOYSA-N
SMILES:
Sc1nnc(o1)C1CC1
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.02g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
142.176g/mol
Monoisotopic Mass:
142.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
65.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
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