CS-0533253
(6R,7S)-7-((Z)-2-(2-Aminothiazol-4-yl)-2-((carboxymethoxy)imino)acetamido)-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, sodium salt Cefixime Impurity
Manufacturer: ChemScene
CAS Number: 124506-28-1
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₆H₁₅N₅NaO₇S₂
Molecular Weight
476.44
Synonyms
Cefixime EP Impurity C (Cefixime 7-epimer) Disodium Salt
SMILES
OC(C1=C(C=C)CS[C@@]([C@H]2NC(/C(C3=CSC(N)=N3)=N\OCC(O)=O)=O)([H])N1C2=O)=O.[Na]
Tpsa
184.51
Logp
-1.1933
H Acceptors
10
H Donors
4
Rotatable Bonds
8
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₅N₅NaO₇S₂
Molecular Weight: 476.44
Synonyms: Cefixime EP Impurity C (Cefixime 7-epimer) Disodium Salt
SMILES: OC(C1=C(C=C)CS[C@@]([C@H]2NC(/C(C3=CSC(N)=N3)=N\OCC(O)=O)=O)([H])N1C2=O)=O.[Na]
Tpsa: 184.51
Logp: -1.1933
H Acceptors: 10
H Donors: 4
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₅N₅NaO₇S₂
Molecular Weight:
476.44
Synonyms:
Cefixime EP Impurity C (Cefixime 7-epimer) Disodium Salt
SMILES:
OC(C1=C(C=C)CS[C@@]([C@H]2NC(/C(C3=CSC(N)=N3)=N\OCC(O)=O)=O)([H])N1C2=O)=O.[Na]
Tpsa:
184.51
Logp:
-1.1933
H Acceptors:
10
H Donors:
4
Rotatable Bonds:
8
Purity: 98%
MDL No: MFCD02751869
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₇NO₃
Molecular Weight: 329.43
Synonyms: N-Benzyl albuterol
SMILES: OC1=CC=C(C(CN(C(C)(C)C)CC2=CC=CC=C2)O)C=C1CO
Tpsa: 63.93
Logp: 3.2186
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 6
Purity:
98%
MDL No:
MFCD02751869
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₇NO₃
Molecular Weight:
329.43
Synonyms:
N-Benzyl albuterol
SMILES:
OC1=CC=C(C(CN(C(C)(C)C)CC2=CC=CC=C2)O)C=C1CO
Tpsa:
63.93
Logp:
3.2186
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₉N₃O₂
Molecular Weight: 179.18
Synonyms: N-Methyl-N'-2-pyridinylethanediamide
SMILES: O=C(C(NC)=O)NC1=NC=CC=C1
Tpsa: 71.09
Logp: -0.2339
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₉N₃O₂
Molecular Weight:
179.18
Synonyms:
N-Methyl-N'-2-pyridinylethanediamide
SMILES:
O=C(C(NC)=O)NC1=NC=CC=C1
Tpsa:
71.09
Logp:
-0.2339
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄₂H₅₄N₁₀O₁₈S₄
Molecular Weight: 1115.19
Synonyms: Cefpodoxime Proxetil 4,7-seco-Dimer
SMILES: CC(C)OC(OC(C)OC(C1=C(COC)CS[C@@]([C@@H]2NC(/C(C3=CSC(NC([C@H]([C@]4([H])NC(C(OC(C)OC(OC(C)C)=O)=O)=C(CS4)COC)NC(/C(C5=CSC(N)=N5)=N\OC)=O)=O)=N3)=N\OC)=O)([H])N1C2=O)=O)=O
Tpsa: 356.74
Logp: 1.7713
H Acceptors: 28
H Donors: 5
Rotatable Bonds: 23
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₂H₅₄N₁₀O₁₈S₄
Molecular Weight:
1115.19
Synonyms:
Cefpodoxime Proxetil 4,7-seco-Dimer
SMILES:
CC(C)OC(OC(C)OC(C1=C(COC)CS[C@@]([C@@H]2NC(/C(C3=CSC(NC([C@H]([C@]4([H])NC(C(OC(C)OC(OC(C)C)=O)=O)=C(CS4)COC)NC(/C(C5=CSC(N)=N5)=N\OC)=O)=O)=N3)=N\OC)=O)([H])N1C2=O)=O)=O
Tpsa:
356.74
Logp:
1.7713
H Acceptors:
28
H Donors:
5
Rotatable Bonds:
23