Home Other Building Blocks 2-(1,1-dioxo-1lambda6-thiolan-3-yl)acetohydrazide

2-(1,1-dioxo-1lambda6-thiolan-3-yl)acetohydrazide

CAS No.:
515169-85-4
Catalog Number:
AG019OM0
Molecular Formula:
C6H12N2O3S
Molecular Weight:
192.2361
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Product Description
Catalog Number:
AG019OM0
Chemical Name:
2-(1,1-dioxo-1lambda6-thiolan-3-yl)acetohydrazide
CAS Number:
515169-85-4
Molecular Formula:
C6H12N2O3S
Molecular Weight:
192.2361
MDL Number:
MFCD07343831
IUPAC Name:
2-(1,1-dioxothiolan-3-yl)acetohydrazide
InChI:
InChI=1S/C6H12N2O3S/c7-8-6(9)3-5-1-2-12(10,11)4-5/h5H,1-4,7H2,(H,8,9)
InChI Key:
BHPBLQYIHLJARH-UHFFFAOYSA-N
SMILES:
NNC(=O)CC1CCS(=O)(=O)C1
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.057g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
192.233g/mol
Monoisotopic Mass:
192.057g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5  
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