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60160-52-3 | N-(2-hydrazino-2-oxoethyl)benzenesulfonamide
CAS No: 60160-52-3 Catalog No: AG00JHHB MDL No:MFCD00453730
Product Description
Catalog Number:
AG00JHHB
Chemical Name:
N-(2-hydrazino-2-oxoethyl)benzenesulfonamide
CAS Number:
60160-52-3
Molecular Formula:
C8H11N3O3S
Molecular Weight:
229.2562
MDL Number:
MFCD00453730
IUPAC Name:
N-(2-hydrazinyl-2-oxoethyl)benzenesulfonamide
InChI:
InChI=1S/C8H11N3O3S/c9-11-8(12)6-10-15(13,14)7-4-2-1-3-5-7/h1-5,10H,6,9H2,(H,11,12)
InChI Key:
MTPQROAGBZYQKF-UHFFFAOYSA-N
SMILES:
NNC(=O)CNS(=O)(=O)c1ccccc1
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.052g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
229.254g/mol
Monoisotopic Mass:
229.052g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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