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Cefazedone sodium

CAT: 0013-GTR19273758-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19273758-02Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Cefazedone sodium is a first-generation cephalosporin (antibiotic) with activity against both Gram-positive and Gram-negative bacteria.
CAS Number
63521-15-3
Smiles
C (O) (=O) C=1N2[C@@] ([C@H] (NC (CN3C=C (Cl) C (=O) C (Cl) =C3) =O) C2=O) (SCC1CSC=4SC (C) =NN4) [H].[Na]
Molecular Formula
C18H16Cl2N5NaO5S3
Molecular Weight
572.43
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Cefazedone Sodium

Cefazedone Sodium is the sodium salt form of cefazedone, a semi-synthetic first-generation, oral cephalosporin with antibacterial activity.

CAS Number63521-15-3
PubChem CID23673603
IUPAC Namesodium (6R,7R)-7-[[2-(3,5-dichloro-4-oxo-1-pyridinyl)acetyl]amino]-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Molecular FormulaC18H14Cl2N5NaO5S3
Molecular Weight570.4
Topological Polar Surface Area214
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count11
Rotatable Bond Count7
Heavy Atom Count34
Formal Charge0
Complexity990
SMILES
CC1=NN=C(S1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)CN4C=C(C(=O)C(=C4)Cl)Cl)SC2)C(=O)[O-].[Na+]
InChI
InChI=1S/C18H15Cl2N5O5S3.Na/c1-7-22-23-18(33-7)32-6-8-5-31-16-12(15(28)25(16)13(8)17(29)30)21-11(26)4-24-2-9(19)14(27)10(20)3-24;/h2-3,12,16H,4-6H2,1H3,(H,21,26)(H,29,30);/q;+1/p-1/t12-,16-;/m1./s1
InChIKey
KPHCAENKLGZHCB-VQZRABBESA-M
Chemical Structure
2D Structure
2D structure of Cefazedone Sodium
CAS: 63521-15-3
CID: 23673603
Formula: C18H14Cl2N5NaO5S3
MW: 570.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight570.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count11
Rotatable Bond Count7
Exact Mass568.9431818
Monoisotopic Mass568.9431818
Topological Polar Surface Area214 Ų
Heavy Atom Count34
Formal Charge0
Complexity990
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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