AG019L5I

Name: 3-[(3-oxopiperazin-1-yl)sulfonyl]benzoic acid
Brand: Angene Chemical
SKU: AG019L5I

926252-37-1 | 3-[(3-oxopiperazin-1-yl)sulfonyl]benzoic acid

AG019L5I

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CAS Number	926252-37-1
Catalog Number	AG019L5I
Chemical Name	3-[(3-oxopiperazin-1-yl)sulfonyl]benzoic acid
IUPAC Name	3-(3-oxopiperazin-1-yl)sulfonylbenzoic acid
InChI	InChI=1S/C11H12N2O5S/c14-10-7-13(5-4-12-10)19(17,18)9-3-1-2-8(6-9)11(15)16/h1-3,6H,4-5,7H2,(H,12,14)(H,15,16)
InChI Key	DUNOHUAXGDZSLY-UHFFFAOYSA-N
MDL Number	MFCD09041489
Molecular Formula	C11H12N2O5S
Molecular Weight	284.2884
SMILES	OC(C1=CC(S(N2CC(=O)NCC2)(=O)=O)=CC=C1)=O
Synonyms	3-[(3-oxopiperazin-1-yl)sulfonyl]benzoic acid, 926252-37-1, AC1Q72U3, CTK7H6540, ZINC12778442, AKOS000123780, MCULE-4832218523, NE14135, 3-(3-oxopiperazine-1-sulfonyl)benzoic acid, EN300-29910, Z53028645,

Complexity	470
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	284.047g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	284.286g/mol
Monoisotopic Mass	284.047g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	112A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited