Catalog No.:AA001STA

1622-55-5 | 9,10-Dihydro-4h-benzo[4,5]cyclohepta[1,2-b]thiophen-4-one

Name: Name:9,10-Dihydro-4h-benzo[4,5]cyclohepta[1,2-b]thiophen-4-one
Brand: AABLOCKS
SKU: AA001STA
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Technical Information
Properties
Downstream Synthesis Route
Literature
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Technical Information
Properties
Downstream Synthesis Route
Literature

Technical Information

Catalog Number:

AA001STA

Chemical Name:

9,10-Dihydro-4h-benzo[4,5]cyclohepta[1,2-b]thiophen-4-one

CAS Number:

1622-55-5

Molecular Formula:

C13H10OS

Molecular Weight:

214.2829

MDL Number:

MFCD00808048

SMILES:

O=C1c2ccccc2CCc2c1ccs2

Properties

Computed Properties

Complexity:

263

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

XLogP3:

3.4

Downstream Synthesis Route

1622-54-4

1622-55-5

[1]Murty;Ramalingam;Sabitha;Yadav[HeterocyclicCommunications,2001,vol.7,#5,p.449-454]

1622-55-5

59743-84-9

[1]Polivka,Zdenek;Budesinsky,Milos;Holubek,Jiri;Schneider,Bohdan;Sediva,Zdenek;etal.[CollectionofCzechoslovakChemicalCommunications,1989,vol.54,#9,p.2443-2469]

Literature

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

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS