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Cefcapene Pivoxil Hydrochloride

CAT: 0957-S4844Size: 25 mgDry Ice: YesHazardous: No
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CAT#:0957-S4844Size:25 mg
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Description
Cefcapene Pivoxil is the pivalate ester prodrug form of cefcapene, a semi-synthetic third-generation cephalosporin with antibacterial activity.
CAS Number
147816-24-8
Target
Bacterial
Activity
Microbiology
Molecular Formula
C23H29N5O8S2.HCl.H2O
Storage Conditions
2 years -80 in solvent

Chemical Information

Cefcapene Pivoxil Hydrochloride Hydrate

Cefcapene Pivoxil Hydrochloride Hydrate is the hydrate hydrochloride salt form of cefcapene pivalate, a prodrug and third-generation cephalosporin with antibacterial activity. After oral administration of cefcapene pivoxil hydrochloride hydrate the ester bond is cleaved, releasing active cefcapene.

CAS Number147816-24-8
PubChem CID5282437
IUPAC Name2,2-dimethylpropanoyloxymethyl (6R,7R)-7-[[(Z)-2-(2-amino-1,3-thiazol-4-yl)pent-2-enoyl]amino]-3-(carbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate;hydrate;hydrochloride
Molecular FormulaC23H32ClN5O9S2
Molecular Weight622.1
Topological Polar Surface Area248
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count13
Rotatable Bond Count13
Heavy Atom Count40
Formal Charge0
Complexity1060
SMILES
CC/C=C(/C1=CSC(=N1)N)\C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)COC(=O)N)C(=O)OCOC(=O)C(C)(C)C.O.Cl
InChI
InChI=1S/C23H29N5O8S2.ClH.H2O/c1-5-6-12(13-9-38-21(24)26-13)16(29)27-14-17(30)28-15(11(7-34-22(25)33)8-37-18(14)28)19(31)35-10-36-20(32)23(2,3)4;;/h6,9,14,18H,5,7-8,10H2,1-4H3,(H2,24,26)(H2,25,33)(H,27,29);1H;1H2/b12-6-;;/t14-,18-;;/m1../s1
InChIKey
LUXIJPQYUCFVAL-XRLCNELCSA-N
Chemical Structure
2D Structure
2D structure of Cefcapene Pivoxil Hydrochloride Hydrate
CAS: 147816-24-8
CID: 5282437
Formula: C23H32ClN5O9S2
MW: 622.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight622.1
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count13
Rotatable Bond Count13
Exact Mass621.1329977
Monoisotopic Mass621.1329977
Topological Polar Surface Area248 Ų
Heavy Atom Count40
Formal Charge0
Complexity1060
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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Alternative Products

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005856Cefcapene Pivoxil Hydrochloride
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