CS-0497679
(6R,7R)-7-((Z)-2-(2-((6R,7R)-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-carboxamido)thiazol-4-yl)-2-((carboxymethoxy)imino)acetamido)-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic 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
C₃₂H₂₈N₁₀O₁₃S₄
Molecular Weight
888.88
Synonyms
None
SMILES
OC(C1=C(C=C)CS[C@@]2([H])N1C([C@@]2([H])NC(/C(C3=CSC(NC(C4=C(C=C)CS[C@@]5([H])N4C([C@@]5([H])NC(/C(C6=CSC(N)=N6)=N\OCC(O)=O)=O)=O)=O)=N3)=N\OCC(O)=O)=O)=O)=O
Tpsa
334.8
Logp
-0.8043
H Acceptors
19
H Donors
7
Rotatable Bonds
17
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: C₃₂H₂₈N₁₀O₁₃S₄
Molecular Weight: 888.88
Synonyms: None
SMILES: OC(C1=C(C=C)CS[C@@]2([H])N1C([C@@]2([H])NC(/C(C3=CSC(NC(C4=C(C=C)CS[C@@]5([H])N4C([C@@]5([H])NC(/C(C6=CSC(N)=N6)=N\OCC(O)=O)=O)=O)=O)=N3)=N\OCC(O)=O)=O)=O)=O
Tpsa: 334.8
Logp: -0.8043
H Acceptors: 19
H Donors: 7
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:
C₃₂H₂₈N₁₀O₁₃S₄
Molecular Weight:
888.88
Synonyms:
None
SMILES:
OC(C1=C(C=C)CS[C@@]2([H])N1C([C@@]2([H])NC(/C(C3=CSC(NC(C4=C(C=C)CS[C@@]5([H])N4C([C@@]5([H])NC(/C(C6=CSC(N)=N6)=N\OCC(O)=O)=O)=O)=O)=N3)=N\OCC(O)=O)=O)=O)=O
Tpsa:
334.8
Logp:
-0.8043
H Acceptors:
19
H Donors:
7
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: C₂₁H₁₈N₆O₅S₄
Molecular Weight: 562.66
Synonyms: None
SMILES: OC(C1=C(CSC2=NC3=C(C=CC=C3)S2)CS[C@@]4([H])N1C([C@@]4([H])NC(/C(C5=CSC(N)=N5)=N\OC)=O)=O)=O
Tpsa: 160.1
Logp: 2.2164
H Acceptors: 12
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:
C₂₁H₁₈N₆O₅S₄
Molecular Weight:
562.66
Synonyms:
None
SMILES:
OC(C1=C(CSC2=NC3=C(C=CC=C3)S2)CS[C@@]4([H])N1C([C@@]4([H])NC(/C(C5=CSC(N)=N5)=N\OC)=O)=O)=O
Tpsa:
160.1
Logp:
2.2164
H Acceptors:
12
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: C₁₃H₁₁NO₂
Molecular Weight: 213.23
Synonyms: None
SMILES: N#CC(O)C1=CC=C2C=C(OC)C=CC2=C1
Tpsa: 53.25
Logp: 2.40538
H Acceptors: 3
H Donors: 1
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:
C₁₃H₁₁NO₂
Molecular Weight:
213.23
Synonyms:
None
SMILES:
N#CC(O)C1=CC=C2C=C(OC)C=CC2=C1
Tpsa:
53.25
Logp:
2.40538
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₂₀ClNO
Molecular Weight: 229.75
Synonyms: None
SMILES: NC(CCCC)C1=CC(OC)=CC=C1.Cl
Tpsa: 35.25
Logp: 3.307
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 5
Purity:
97%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₂₀ClNO
Molecular Weight:
229.75
Synonyms:
None
SMILES:
NC(CCCC)C1=CC(OC)=CC=C1.Cl
Tpsa:
35.25
Logp:
3.307
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
5