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Ceftazidime Impurity 70

CAT: 1299-RM-C062170-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-C062170-02Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2259869-88-8
Synonyms
S- (benzo[d]thiazol-2-yl) 2- (((1- (2-aminothiazol-4-yl) -2- (benzo[d]thiazol-2-ylthio) -2-oxoethylidene) amino) oxy) -2-methylpropanethioate
Molecular Formula
C23H17N5O3S5
Molecular Weight
571.72
Target Alternative Name
Ceftazidime
Product Name Synonym
S- (benzo[d]thiazol-2-yl) 2- (((1- (2-aminothiazol-4-yl) -2- (benzo[d]thiazol-2-ylthio) -2-oxoethylidene) amino) oxy) -2-methylpropanethioate

Chemical Information

S-(Benzo[d]thiazol-2-yl) 2-(((1-(2-aminothiazol-4-yl)-2-(benzo[d]thiazol-2-ylthio)-2-oxoethylidene)amino)oxy)-2-methylpropanethioate
CAS Number2259869-88-8
PubChem CID177837285
IUPAC NameS-(1,3-benzothiazol-2-yl) 2-[[1-(2-amino-1,3-thiazol-4-yl)-2-(1,3-benzothiazol-2-ylsulfanyl)-2-oxoethylidene]amino]oxy-2-methylpropanethioate
Molecular FormulaC23H17N5O3S5
Molecular Weight571.7
XLogP7.5
Topological Polar Surface Area256
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count13
Rotatable Bond Count9
Heavy Atom Count36
Formal Charge0
Complexity864
SMILES
CC(C)(C(=O)SC1=NC2=CC=CC=C2S1)ON=C(C3=CSC(=N3)N)C(=O)SC4=NC5=CC=CC=C5S4
InChI
InChI=1S/C23H17N5O3S5/c1-23(2,19(30)36-22-27-13-8-4-6-10-16(13)34-22)31-28-17(14-11-32-20(24)25-14)18(29)35-21-26-12-7-3-5-9-15(12)33-21/h3-11H,1-2H3,(H2,24,25)
InChIKey
WIFONLPGUPVKPF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of S-(Benzo[d]thiazol-2-yl) 2-(((1-(2-aminothiazol-4-yl)-2-(benzo[d]thiazol-2-ylthio)-2-oxoethylidene)amino)oxy)-2-methylpropanethioate
CAS: 2259869-88-8
CID: 177837285
Formula: C23H17N5O3S5
MW: 571.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight571.7
XLogP37.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count13
Rotatable Bond Count9
Exact Mass570.99349529
Monoisotopic Mass570.99349529
Topological Polar Surface Area256 Ų
Heavy Atom Count36
Formal Charge0
Complexity864
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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