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4,5,6,7-Tetrahydrobenzothiophene-2-carboxamide

4,5,6,7-Tetrahydrobenzothiophene-2-carboxamide - CAS 57021-58-6

Catalog:	BB029562
Product Name:	4,5,6,7-Tetrahydrobenzothiophene-2-carboxamide
CAS:	57021-58-6
Synonyms:	4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide; 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Technical Data

Patents

Computed Properties

IUPAC Name:	4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
Description:	4,5,6,7-Tetrahydrobenzothiophene-2-carboxamide (CAS# 57021-58-6 ) is a useful research chemical.
Molecular Weight:	181.25
Molecular Formula:	C9H11NOS
Canonical SMILES:	C1CCC2=C(C1)C=C(S2)C(=O)N
InChI:	InChI=1S/C9H11NOS/c10-9(11)8-5-6-3-1-2-4-7(6)12-8/h5H,1-4H2,(H2,10,11)
InChI Key:	MDTDPEHJGYVJHS-UHFFFAOYSA-N
LogP:	2.42610

Publication Number	Title	Priority Date
WO-2021119503-A1	Controlled-delivery cromakalim prodrugs	20191212
AU-2018291026-A1	Morphic forms of GIT38 and methods of manufacture thereof	20170629
EP-3454862-A1	Spirocyclic degronimers for target protein degradation	20160510
EP-3455218-A1	C3-carbon linked glutarimide degronimers for target protein degradation	20160510
WO-2017197036-A1	Spirocyclic degronimers for target protein degradation	20160510

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[55441-25-3]
1-(2-Cyanophenyl)urea
[957292-12-5]
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid
[2168559-63-3]
2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride

Complexity:	195
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	181.05613515
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	181.05613515
Rotatable Bond Count:	1
Topological Polar Surface Area:	71.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2