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Compound Fr13078

CAT: 0931-Fr13078-02Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0931-Fr13078-02Size:2 mg
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CAS Number
4284-51-9
Bioactivity
Compound Fr13078, with CAS No. 4284-51-9, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound Fr13078 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.
Smiles
CS(=O)(=O)Nc1ccc(Cl)cc1
Molecular Formula
C7H8ClNO2S
Molecular Weight
205.66
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-(4-Chlorophenyl)methanesulfonamide

N-(4-chlorophenyl)methanesulfonamide is a sulfonamide.

CAS Number4284-51-9
PubChem CID706838
IUPAC NameN-(4-chlorophenyl)methanesulfonamide
Molecular FormulaC7H8ClNO2S
Molecular Weight205.66
XLogP1.8
Topological Polar Surface Area54.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity226
SMILES
CS(=O)(=O)NC1=CC=C(C=C1)Cl
InChI
InChI=1S/C7H8ClNO2S/c1-12(10,11)9-7-4-2-6(8)3-5-7/h2-5,9H,1H3
InChIKey
TZBQEYJPVLKASB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(4-Chlorophenyl)methanesulfonamide
CAS: 4284-51-9
CID: 706838
Formula: C7H8ClNO2S
MW: 205.66
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight205.66
XLogP31.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass204.9964274
Monoisotopic Mass204.9964274
Topological Polar Surface Area54.6 Ų
Heavy Atom Count12
Formal Charge0
Complexity226
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
Fr13098-01Compound Fr13098
Fr14078-01Compound Fr14078
Fr13018-01Compound Fr13018
Fr13278-01Compound Fr13278
Fr13077-01Compound Fr13077
Fr13073-01Compound Fr13073
Fr13478-01Compound Fr13478
Fr13778-01Compound Fr13778
Fr13678-01Compound Fr13678
Fr13058-01Compound Fr13058

Alternative Products

CatalogName
ALX-550-516-M025Compound A
A8197-5.1Compound 56
C8444-50Compound C108
C5824-10GPR120 Compound A
B7337-5Compound 401
XXC35825-01Compound 3a
HY-U00358Compound 2
HY-14176-01Compound E
2573-5Compound 112254
1898-1000Compound 34

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