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Cefathiamidine

CAT: 1410-M21185-05Size: 100 mgDry Ice: NoHazardous: No
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CAT#:1410-M21185-05Size:100 mg
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Description
Cefathiamidine exhibits a wide spectrum of antimicrobial activity against bacteria. Cefathiamidine is used for the treatment of respiratory liver five senses urinary tract infections endocarditis and sepsis.
CAS Number
33075-00-2
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
472.6
Molecular Formula
C19H28N4O6S2
Notes
Research use only, not for human use.
Receptor
Bacterial

Chemical Information

Cefathiamidine

Cefathiamidine is a cephalosporin.

CAS Number33075-00-2
PubChem CID15942748
IUPAC Name(6R,7R)-3-(acetyloxymethyl)-7-[[2-[N,N'-di(propan-2-yl)carbamimidoyl]sulfanylacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Molecular FormulaC19H28N4O6S2
Molecular Weight472.6
XLogP0.5
Topological Polar Surface Area188
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count11
Heavy Atom Count31
Formal Charge0
Complexity811
SMILES
CC(C)NC(=NC(C)C)SCC(=O)N[C@H]1[C@@H]2N(C1=O)C(=C(CS2)COC(=O)C)C(=O)O
InChI
InChI=1S/C19H28N4O6S2/c1-9(2)20-19(21-10(3)4)31-8-13(25)22-14-16(26)23-15(18(27)28)12(6-29-11(5)24)7-30-17(14)23/h9-10,14,17H,6-8H2,1-5H3,(H,20,21)(H,22,25)(H,27,28)/t14-,17-/m1/s1
InChIKey
JYXACOFERDBGGQ-RHSMWYFYSA-N
Chemical Structure
2D Structure
2D structure of Cefathiamidine
CAS: 33075-00-2
CID: 15942748
Formula: C19H28N4O6S2
MW: 472.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight472.6
XLogP30.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count11
Exact Mass472.14502697
Monoisotopic Mass472.14502697
Topological Polar Surface Area188 Ų
Heavy Atom Count31
Formal Charge0
Complexity811
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
TRC-C237550-1GCefathiamidine
INB00161-01Desacetyl cefathiamidine
RM-C062001-01Cefathiamidine Impurity A
TRC-C237552-10MGCefathiamidine-d14
HY-107329RCefathiamidine (Standard)
AR-C01680-01Cefathiamidine Impurity

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