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38985-70-5,MFCD00041297
Catalog No.:AA00C0G2

38985-70-5 | 4-(4-Nitrophenyl)-3-thiosemicarbazide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
in stock  
$56.00   $39.00
- +
1g
in stock  
$108.00   $75.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00C0G2
Chemical Name:
4-(4-Nitrophenyl)-3-thiosemicarbazide
CAS Number:
38985-70-5
Molecular Formula:
C7H8N4O2S
Molecular Weight:
212.2290
MDL Number:
MFCD00041297
SMILES:
NNC(=S)Nc1ccc(cc1)[N+](=O)[O-]
Properties
Properties
 
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
222  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.6  

Downstream Synthesis Route
1646-26-0    38985-70-5   
2-(1-(benzofuran-2-yl)ethylidene)-N-(4-nitrophenyl)hydrazinecarbothioamide 

[1]Hameed,Abdul;Khan,KhalidMohammed;Zehra,SyedaTazeen;Ahmed,Ramasa;Shafiq,Zahid;Bakht,SyedaMahwish;Yaqub,Muhammad;Hussain,Mazhar;DeLaVegaDeLeón,Antonio;Furtmann,Norbert;Bajorath,Jürgen;Shad,HazoorAhmad;Tahir,MuhammadNawaz;Iqbal,Jamshed[BioorganicChemistry,2015,vol.61,p.51-57]

21913-84-8    38985-70-5   
2-((5-ethylpyridin-2-yl)methylene)-N-(4'-nitrophenyl)hydrazinecarbothioamide 

[1]EuropeanJournalofMedicinalChemistry,2016,vol.117,p.335-354

38985-70-5    26518-71-8   
N-(4-nitrophenyl)-2-(1-(3-oxo-3,4-dihydro-2H-benzob1,4oxazin-6-yl)ethylidene)hydrazinecarbothioamide 

[1]Shehzad,MuhammadTariq;Imran,Aqeel;Njateng,GuySedarSingor;Hameed,Abdul;Islam,Muhammad;al-Rashida,Mariya;Uroos,Maliha;Asari,Asnuzilawati;Shafiq,Zahid;Iqbal,Jamshed[BioorganicChemistry,2019,vol.87,p.857-866]

[1]Şener,İzzet;Şahin,Çiğdem;Demir,Serkan;Şener,Nesrin;Gür,Mahmut[JournalofMolecularStructure,2020,vol.1203]

39755-95-8    38985-70-5   
C16H13N5O4S 

[1]Muğlu,Halit[ResearchonChemicalIntermediates,2020,vol.46,#4,p.2083-2098]

[2]Bal,Halil;Doğan,Murat;Gülçin,İlham;Güzel,Emre;Koçyiğit,ÜmitM.;Muğlu,Halit;Tüzün,Burak;Taslimi,Parham;Yakan,Hasan[JournalofMolecularStructure,2022,vol.1264]

Literature
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SDS
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Tags:38985-70-5 Molecular Formula|38985-70-5 MDL|38985-70-5 SMILES|38985-70-5 4-(4-Nitrophenyl)-3-thiosemicarbazide
Catalog No.: AA00C0G2
38985-70-5,MFCD00041297
38985-70-5 | 4-(4-Nitrophenyl)-3-thiosemicarbazide
Pack Size： 250mg
Purity：
in stock
$56.00 $39.00
Pack Size： 1g
Purity：
in stock
$108.00 $75.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00C0G2
Chemical Name: 4-(4-Nitrophenyl)-3-thiosemicarbazide
CAS Number: 38985-70-5
Molecular Formula: C7H8N4O2S
Molecular Weight: 212.2290
MDL Number: MFCD00041297
SMILES: NNC(=S)Nc1ccc(cc1)[N+](=O)[O-]
Properties
Storage: Room Temperature;  
Complexity: 222  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 3  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.6  
Downstream Synthesis Route
1646-26-0    38985-70-5   
2-(1-(benzofuran-2-yl)ethylidene)-N-(4-nitrophenyl)hydrazinecarbothioamide 

[1]Hameed,Abdul;Khan,KhalidMohammed;Zehra,SyedaTazeen;Ahmed,Ramasa;Shafiq,Zahid;Bakht,SyedaMahwish;Yaqub,Muhammad;Hussain,Mazhar;DeLaVegaDeLeón,Antonio;Furtmann,Norbert;Bajorath,Jürgen;Shad,HazoorAhmad;Tahir,MuhammadNawaz;Iqbal,Jamshed[BioorganicChemistry,2015,vol.61,p.51-57]

21913-84-8    38985-70-5   
2-((5-ethylpyridin-2-yl)methylene)-N-(4'-nitrophenyl)hydrazinecarbothioamide 

[1]EuropeanJournalofMedicinalChemistry,2016,vol.117,p.335-354

38985-70-5    26518-71-8   
N-(4-nitrophenyl)-2-(1-(3-oxo-3,4-dihydro-2H-benzob1,4oxazin-6-yl)ethylidene)hydrazinecarbothioamide 

[1]Shehzad,MuhammadTariq;Imran,Aqeel;Njateng,GuySedarSingor;Hameed,Abdul;Islam,Muhammad;al-Rashida,Mariya;Uroos,Maliha;Asari,Asnuzilawati;Shafiq,Zahid;Iqbal,Jamshed[BioorganicChemistry,2019,vol.87,p.857-866]

964-68-1    38985-70-5    2398522-68-2 

[1]Şener,İzzet;Şahin,Çiğdem;Demir,Serkan;Şener,Nesrin;Gür,Mahmut[JournalofMolecularStructure,2020,vol.1203]

39755-95-8    38985-70-5   
C16H13N5O4S 

[1]Muğlu,Halit[ResearchonChemicalIntermediates,2020,vol.46,#4,p.2083-2098]

[2]Bal,Halil;Doğan,Murat;Gülçin,İlham;Güzel,Emre;Koçyiğit,ÜmitM.;Muğlu,Halit;Tüzün,Burak;Taslimi,Parham;Yakan,Hasan[JournalofMolecularStructure,2022,vol.1264]

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