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Compound Fr13663

CAT: 0013-GTR19269947-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19269947-02Size:5 mg
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Description
Compound Fr13663, with CAS No. 50382-32-6, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound Fr13663 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
50382-32-6
Smiles
CC1=NC (C) =C (CO) S1
Molecular Formula
C6H9NOS
Molecular Weight
143.21
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(Dimethyl-1,3-thiazol-5-yl)methanol
CAS Number50382-32-6
PubChem CID2776250
IUPAC Name(2,4-dimethyl-1,3-thiazol-5-yl)methanol
Molecular FormulaC6H9NOS
Molecular Weight143.21
XLogP0.9
Topological Polar Surface Area61.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity99
SMILES
CC1=C(SC(=N1)C)CO
InChI
InChI=1S/C6H9NOS/c1-4-6(3-8)9-5(2)7-4/h8H,3H2,1-2H3
InChIKey
BRQKYVQSAUQHNC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (Dimethyl-1,3-thiazol-5-yl)methanol
CAS: 50382-32-6
CID: 2776250
Formula: C6H9NOS
MW: 143.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight143.21
XLogP30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass143.04048508
Monoisotopic Mass143.04048508
Topological Polar Surface Area61.4 Ų
Heavy Atom Count9
Formal Charge0
Complexity99.1
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

CatalogName
GTR19270144-01Compound Fr16663
GTR19269956-01Compound Fr13693
GTR19269949-01Compound Fr13667
GTR19269948-01Compound Fr13664
GTR19269953-01Compound Fr13683
GTR19269951-01Compound Fr13673
GTR19269950-01Compound Fr13668
GTR19269976-01Compound Fr13783
GTR19269958-01Compound Fr13696
GTR19269940-01Compound Fr13618

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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