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Ziprasidone-d8

CAT: 1596-AR-Z01083-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-Z01083-02Size:25 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1126745-58-1
Synonyms
5-[2-[4- (1,2-benzisothiazol-3-yl) -1-piperazinyl-2,2,3,3,5,5,6,6-d8]ethyl]-6-chloro-1,3-dihydro-2H-Indol-2-one;5-{2-[4- (1,2-Benzothiazol-3-yl) (2H8) -1-piperazinyl]ethyl}-6-chloro-1,3-dihydro-2H-indol-2-one; Ziprasidone- (piperazine-d8) ; ZIPRASIDONE-D8;5-[2-[4- (1,2-benzothiazol-3-yl) -2,2,3,3,5,5,6,6-octadeuteriopiperazin-1-yl]ethyl]-6-chloro-1,3-dihydroindol-2-one; CP-88059 D8; Geodon D8; Geodon D8; CP-88059 D8
Molecular Formula
C21H13ClN4OSD8
Molecular Weight
420.99
API Name
Ziprasidone

Chemical Information

Ziprasidone-d8
CAS Number1126745-58-1
PubChem CID25216238
IUPAC Name5-[2-[4-(1,2-benzothiazol-3-yl)-2,2,3,3,5,5,6,6-octadeuteriopiperazin-1-yl]ethyl]-6-chloro-1,3-dihydroindol-2-one
Molecular FormulaC21H21ClN4OS
Molecular Weight421.0
XLogP4
Topological Polar Surface Area76.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count28
Formal Charge0
Complexity573
SMILES
[2H]C1(C(N(C(C(N1CCC2=C(C=C3C(=C2)CC(=O)N3)Cl)([2H])[2H])([2H])[2H])C4=NSC5=CC=CC=C54)([2H])[2H])[2H]
InChI
InChI=1S/C21H21ClN4OS/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)28-24-21/h1-4,11,13H,5-10,12H2,(H,23,27)/i7D2,8D2,9D2,10D2
InChIKey
MVWVFYHBGMAFLY-UFBJYANTSA-N
Chemical Structure
2D Structure
2D structure of Ziprasidone-d8
CAS: 1126745-58-1
CID: 25216238
Formula: C21H21ClN4OS
MW: 421.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight421.0
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass420.1626741
Monoisotopic Mass420.1626741
Topological Polar Surface Area76.7 Ų
Heavy Atom Count28
Formal Charge0
Complexity573
Isotope Atom Count8
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
MBS3846412-01Ziprasidone D8
TRC-Z485002-10MGZiprasidone-d8
452071-01Hydroxy Ziprasidone-d8
A21989-10Ziprasidone D8 10mg
A21989-1Ziprasidone D8 1mg
A21989-5Ziprasidone D8 5mg
sc-476201Ziprasidone N-oxide-d8
sc-484540N-Methyl Ziprasidone-d8
CS-O-46241N-Nitroso Ziprasidone EP Impurity A D8
292154-01Ziprasidone

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