Home Amines 5936-58-3
5936-58-3,MFCD00466265
Catalog No.:AA00EABL

5936-58-3 | 2-Amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid

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1g
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5g
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$35.00   $25.00
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00EABL
Chemical Name:
2-Amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid
CAS Number:
5936-58-3
Molecular Formula:
C9H11NO2S
Molecular Weight:
197.2541
MDL Number:
MFCD00466265
SMILES:
OC(=O)c1c(N)sc2c1CCCC2
Properties
Computed Properties
 
Complexity:
222  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
2.6  

Upstream Synthesis Route

[1]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2005,vol.44,#11,p.2367-2371

[2]SyntheticCommunications,1997,vol.27,#3,p.473-482

[3]BioorganicandMedicinalChemistryLetters,2007,vol.17,#13,p.3562-3569

[4]Pharmazie,1980,vol.35,#5-6,p.326-327

[5]Tetrahedron,2008,vol.64,#7,p.1430-1434

[6]BioorganicandMedicinalChemistry,2006,vol.14,#7,p.2358-2365

[7]OrganicandBiomolecularChemistry,2016,vol.14,#25,p.6119-6133

[8]Patent:WO2006/52722,2006,A1,.Locationinpatent:Page/Pagecolumn44

[9]SyntheticCommunications,2011,vol.41,#19,p.2811-2821

[10]Patent:WO2015/158908,2015,A1,.Locationinpatent:Page/Pagecolumn50

[11]EuropeanJournalofMedicinalChemistry,2017,vol.138,p.38-50

[12]Patent:CN107253944,2017,A,.Locationinpatent:Paragraph0071;0072;0073

[1]Patent:WO2017/184947,2017,A1,.Locationinpatent:Paragraph00211;00212

[1]SyntheticCommunications,2011,vol.41,#19,p.2811-2821

[2]OrganicandBiomolecularChemistry,2016,vol.14,#25,p.6119-6133

[3]EuropeanJournalofMedicinalChemistry,2017,vol.138,p.38-50

[4]Patent:CN107253944,2017,A,

[1]Patent:CN107253944,2017,A,

Downstream Synthesis Route

[1]JournalofChemicalResearch,Miniprint,2002,p.149-153

[2]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2005,vol.44,p.2367-2371

[3]Journalofmedicinalchemistry,1972,vol.15,p.106-107

[1]JournalofMedicinalChemistry,1979,vol.22,p.505-510

[1]JournalfurpraktischeChemie(Leipzig1954),1973,vol.315,p.539-548

[1]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2005,vol.44,p.2367-2371

[2]SyntheticCommunications,1997,vol.27,p.473-482

[3]BioorganicandMedicinalChemistryLetters,2007,vol.17,p.3562-3569

[4]Pharmazie,1980,vol.35,p.326-327

[5]Tetrahedron,2008,vol.64,p.1430-1434

[6]BioorganicandMedicinalChemistry,2006,vol.14,p.2358-2365

[7]OrganicandBiomolecularChemistry,2016,vol.14,p.6119-6133

[8]Patent:WO2006/52722,2006,A1.Locationinpatent:Page/Pagecolumn44

[9]SyntheticCommunications,2011,vol.41,p.2811-2821

[10]Patent:WO2015/158908,2015,A1.Locationinpatent:Page/Pagecolumn50

[11]EuropeanJournalofMedicinalChemistry,2017,vol.138,p.38-50

[12]Patent:CN107253944,2017,A.Locationinpatent:Paragraph0071;0072;0073

[13]JournalofAsianNaturalProductsResearch,2020,vol.22,p.69-82

[1]JournalofMedicinalChemistry,1991,vol.34,p.1492-1503

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Ethyl 2-benzamido-4,5,6,7-tetra-hydro-1-benzothio-phene-3-carboxyl-ate.

Journal: Acta crystallographica. Section E, Structure reports online 20101001

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SDS
Tags:5936-58-3 Molecular Formula|5936-58-3 MDL|5936-58-3 SMILES|5936-58-3 2-Amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid