AG00ADJC

Name: Ziprasidone sulfoxide
Brand: Angene Chemical
SKU: AG00ADJC

188797-80-0 | Ziprasidone sulfoxide

AG00ADJC

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CAS Number	188797-80-0
Catalog Number	AG00ADJC(AGN-PC-0QI2OK)
Chemical Name	Ziprasidone sulfoxide
IUPAC Name	6-chloro-5-[2-[4-(1-oxo-1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-1,3-dihydroindol-2-one
InChI	InChI=1S/C21H21ClN4O2S/c22-17-13-18-15(12-20(27)23-18)11-14(17)5-6-25-7-9-26(10-8-25)21-16-3-1-2-4-19(16)29(28)24-21/h1-4,11,13H,5-10,12H2,(H,23,27)
InChI Key	XYYQWGUKBVTGJQ-UHFFFAOYSA-N
MDL Number	MFCD29045639
Molecular Formula	C21H21ClN4O2S
Molecular Weight	428.9350
SMILES	Clc1cc2NC(=O)Cc2cc1CCN3CCN(CC3)C4=NS(=O)c5ccccc45
Synonyms	Ziprasidone Sulfoxide, 188797-80-0, Ziprasidone sulphoxide, DTXSID90580482, XYYQWGUKBVTGJQ-UHFFFAOYSA-N, ZINC34821823, ZINC248070493, ZINC248070498, ACM188797800, FT-0675914, 3-{4-[2-(6-Chloro-2-oxo-2,3-dihydro-1H-indol-5-yl)ethyl]piperazin-1-yl}-1H-1lambda~4~,2-benzothiazol-1-one, 6-Chloro-1,3-dihydro-5-[2-[4-(1-oxido-1,2-benzisothiazol-3-yl)-1-piperazinyl]ethyl]-2H-indol-2-one,

Complexity	696
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	428.107g/mol
Formal Charge	0
Heavy Atom Count	29
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	428.935g/mol
Monoisotopic Mass	428.107g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	84.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

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