CS-0497619
2-(((Z)-(1-(2-Aminothiazol-4-yl)-2-(((6R,7R)-2-(tert-butoxycarbonyl)-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl)amino)-2-oxoethylidene)amino)oxy)acetic acid Cefixime Impurity
Manufacturer: ChemScene
CAS Number: None
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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
C₂₀H₂₃N₅O₇S₂
Molecular Weight
509.56
Synonyms
None
SMILES
[H][C@@]1(NC(/C(C2=CSC(N)=N2)=N\OCC(O)=O)=O)C(N3[C@]1([H])SCC(C=C)=C3C(OC(C)(C)C)=O)=O
Tpsa
173.51
Logp
0.7123
H Acceptors
11
H Donors
3
Rotatable Bonds
8
Other Options
...
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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: C₂₀H₂₃N₅O₇S₂
Molecular Weight: 509.56
Synonyms: None
SMILES: [H][C@@]1(NC(/C(C2=CSC(N)=N2)=N\OCC(O)=O)=O)C(N3[C@]1([H])SCC(C=C)=C3C(OC(C)(C)C)=O)=O
Tpsa: 173.51
Logp: 0.7123
H Acceptors: 11
H Donors: 3
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:
C₂₀H₂₃N₅O₇S₂
Molecular Weight:
509.56
Synonyms:
None
SMILES:
[H][C@@]1(NC(/C(C2=CSC(N)=N2)=N\OCC(O)=O)=O)C(N3[C@]1([H])SCC(C=C)=C3C(OC(C)(C)C)=O)=O
Tpsa:
173.51
Logp:
0.7123
H Acceptors:
11
H Donors:
3
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: C₉H₁₂N₂O₅S
Molecular Weight: 260.27
Synonyms: None
SMILES: O=C(O)[C@H]1C(C)(C)SC2N1C(O)=NC2C(O)=O
Tpsa: 110.43
Logp: -0.0261
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₂N₂O₅S
Molecular Weight:
260.27
Synonyms:
None
SMILES:
O=C(O)[C@H]1C(C)(C)SC2N1C(O)=NC2C(O)=O
Tpsa:
110.43
Logp:
-0.0261
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₈H₃₂N₁₀O₁₃S₆
Molecular Weight: 1029.11
Synonyms: None
SMILES: OC(C1=C(CSC(C2=CC=CO2)=O)CS[C@@]3([H])N1C([C@H]3NC(/C(C4=CSC(NC(C5=C(CSC(C6=CC=CO6)=O)CS[C@@]7([H])N5C([C@H]7NC(/C(C8=CSC(N)=N8)=N\OC)=O)=O)=O)=N4)=N\OC)=O)=O)=O
Tpsa: 320.62
Logp: 2.2473
H Acceptors: 23
H Donors: 5
Rotatable Bonds: 17
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₈H₃₂N₁₀O₁₃S₆
Molecular Weight:
1029.11
Synonyms:
None
SMILES:
OC(C1=C(CSC(C2=CC=CO2)=O)CS[C@@]3([H])N1C([C@H]3NC(/C(C4=CSC(NC(C5=C(CSC(C6=CC=CO6)=O)CS[C@@]7([H])N5C([C@H]7NC(/C(C8=CSC(N)=N8)=N\OC)=O)=O)=O)=N4)=N\OC)=O)=O)=O
Tpsa:
320.62
Logp:
2.2473
H Acceptors:
23
H Donors:
5
Rotatable Bonds:
17
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₂H₂₇N₇O₁₁S₅
Molecular Weight: 845.92
Synonyms: None
SMILES: OC(C1=C(CSC(C2=CC=CO2)=O)CS[C@@]3([H])N1C([C@@]3([H])NC(C4=C(CSC(C5=CC=CO5)=O)CS[C@@]6([H])N4C([C@@]6([H])NC(/C(C7=CSC(N)=N7)=N\OC)=O)=O)=O)=O)=O
Tpsa: 257.04
Logp: 1.8016
H Acceptors: 18
H Donors: 4
Rotatable Bonds: 13
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₂H₂₇N₇O₁₁S₅
Molecular Weight:
845.92
Synonyms:
None
SMILES:
OC(C1=C(CSC(C2=CC=CO2)=O)CS[C@@]3([H])N1C([C@@]3([H])NC(C4=C(CSC(C5=CC=CO5)=O)CS[C@@]6([H])N4C([C@@]6([H])NC(/C(C7=CSC(N)=N7)=N\OC)=O)=O)=O)=O)=O
Tpsa:
257.04
Logp:
1.8016
H Acceptors:
18
H Donors:
4
Rotatable Bonds:
13