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Compound Fr13673

CAT: 0013-GTR19269951-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19269951-01Size:1 mg
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Description
Compound Fr13673, with CAS No. 83933-16-8, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound Fr13673 provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
CAS Number
83933-16-8
Purity
97.76% (May vary between batches)
Smiles
Cc1csc (c1) C (N) =O
Molecular Formula
C6H7NOS
Molecular Weight
141.19
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

4-Methylthiophene-2-carboxamide

4-Methylthiophene-2-carboxamide is a member of thiophenes and an aromatic amide.

CAS Number83933-16-8
PubChem CID2795529
IUPAC Name4-methylthiophene-2-carboxamide
Molecular FormulaC6H7NOS
Molecular Weight141.19
XLogP1.2
Topological Polar Surface Area71.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity126
SMILES
CC1=CSC(=C1)C(=O)N
InChI
InChI=1S/C6H7NOS/c1-4-2-5(6(7)8)9-3-4/h2-3H,1H3,(H2,7,8)
InChIKey
KESQGXHWTOVOQT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Methylthiophene-2-carboxamide
CAS: 83933-16-8
CID: 2795529
Formula: C6H7NOS
MW: 141.19
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight141.19
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass141.02483502
Monoisotopic Mass141.02483502
Topological Polar Surface Area71.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity126
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

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GTR19269953-01Compound Fr13683
GTR19269940-01Compound Fr13618
GTR19269936-01Compound Fr13576
GTR19269925-01Compound Fr13453
GTR19269900-01Compound Fr13279
GTR19269881-01Compound Fr13143

Alternative Products

CatalogName
ALX-550-516-M025Compound A
XXC35825-01Compound 3a
Fr16729-01Compound Fr16729
PDK0296-01Compound PDK0296
PDK0264-01Compound PDK0264
Fr14090-01Compound Fr14090
Fr14018-01Compound Fr14018
Fr13991-01Compound Fr13991
Fr13830-01Compound Fr13830
Fr13814-01Compound Fr13814

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