Name: Name:Methyl 2-amino-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Brand: AABLOCKS
SKU: AA000OYH
Rating: 90 (10 reviews)

Catalog No.: AA000OYH

119004-72-7 | Methyl 2-amino-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Pack Size： 1g

Purity： 95%

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Pack Size： 5g

Purity： 95%

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Technical Information

Catalog Number: AA000OYH

Chemical Name: Methyl 2-amino-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

CAS Number: 119004-72-7

Molecular Formula: C16H17NO2S

Molecular Weight: 287.3767

MDL Number: MFCD01922029

SMILES: COC(=O)c1c(N)sc2c1CCC(C2)c1ccccc1

Properties

Complexity: 356

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 20

Hydrogen Bond Acceptor Count: 4

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 3

Undefined Atom Stereocenter Count: 1

Undefined Bond Stereocenter Count: 0

XLogP3: 4.3

Downstream Synthesis Route

4894-75-1

105-34-0

119004-72-7

[1]TheDang,Hung;Chorell,Erik;Uvell,Hanna;Pinkner,JeromeS.;Hultgren,ScottJ.;Almqvist,Fredrik[OrganicandBiomolecularChemistry,2014,vol.12,#12,p.1942-1956]

[2]CurrentPatentAssignee:ENYOPHARMA-WO2019/154949,2019,A1Locationinpatent:Page/Pagecolumn120

[3]Adib,Mehdi;Bayanati,Maryam;Soheilizad,Mehdi;Ghazvini,HeliaJanatian;Tajbakhsh,Mahmood;Amanlou,Massoud[Synlett,2014,vol.25,#9]

27914-73-4

119004-72-7

methyl2-(4-hydroxybenzamido)-6-phenyl-4,5,6,7-tetrahydrobenzobthiophene-3-carboxylate

[1]CurrentPatentAssignee:ENYOPHARMA-WO2019/154949,2019,A1Locationinpatent:Page/Pagecolumn79;80

4894-75-1

105-56-6

119004-72-7

[1]Balzarini,Jan;Brancale,Andrea;Cacciari,Barbara;Ferla,Salvatore;Finotti,Alessia;Gambari,Roberto;Hamel,Ernest;Liekens,Sandra;Manfredini,Stefano;Oliva,Paola;Prencipe,Filippo;Romagnoli,Romeo;Zurlo,Matteo[Molecules,2020,vol.25,#7]