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2-[(2-NITROPHENYL)THIO]ETHANOHYDRAZIDE

2-[(2-NITROPHENYL)THIO]ETHANOHYDRAZIDE structure

CAS No:
4871-40-3
Formula:
C8H9N3O3S
Chemical Name:
2-[(2-NITROPHENYL)THIO]ETHANOHYDRAZIDE
Synonyms:
2-[(2-nitrophenyl)thio]ethanohydrazide;MAC13772;2-(2-Nitrophenylthio)acetohydrazide;2-[(2-nitrophenyl)sulfanyl]acetohydrazide;2-((2-Nitrophenyl)thio)acetohydrazide;2-((2-Nitrophenyl)thio)ethanohydrazide;2-(2-nitrophenyl)sulfanylacetohydrazide;Maybridge1_003460;CHEMBL3727969;SCHEMBL11863767

Description

MAC13772 is a potent inhibitor of the enzyme BioA (IC50=250 nM), the antepenultimate step in biotin biosynthesis. MAC13772 is a novel antibacterial compound[1].

2-[(2-NITROPHENYL)THIO]ETHANOHYDRAZIDE Basic Attributes

Molecular Weight：

227.238

Exact Mass：

227.03600

DSSTox ID：

DTXSID80384537

Characteristics

PSA：

126

XLogP3：

2.29120

Density：

1.44 g/cm3

Boiling Point：

461ºC at 760mmHg

Flash Point：

232.6ºC

Refractive Index：

1.649

Computed Properties

Molecular Weight:227.24
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:227.03646233
Monoisotopic Mass:227.03646233
Topological Polar Surface Area:126
Heavy Atom Count:15
Complexity:244
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(2-NITROPHENYL)THIO]ETHANOHYDRAZIDE

Description
Basic Attributes
Characteristics
Computed Properties

2-[(2-NITROPHENYL)THIO]ETHANOHYDRAZIDE

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