CS-0497625
(6R,7R)-3-(((Furan-2-carbonyl)thio)methyl)-7-((Z)-2-(2-(furan-2-carboxamido)thiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Ceftiofur 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
C₂₄H₁₉N₅O₉S₃
Molecular Weight
617.63
Synonyms
None
SMILES
OC(C1=C(CSC(C2=CC=CO2)=O)CS[C@@]3([H])N1C([C@@]3([H])NC(/C(C4=CSC(NC(C5=CC=CO5)=O)=N4)=N\OC)=O)=O)=O
Tpsa
193.64
Logp
2.2441
H Acceptors
13
H Donors
3
Rotatable Bonds
10
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: C₂₄H₁₉N₅O₉S₃
Molecular Weight: 617.63
Synonyms: None
SMILES: OC(C1=C(CSC(C2=CC=CO2)=O)CS[C@@]3([H])N1C([C@@]3([H])NC(/C(C4=CSC(NC(C5=CC=CO5)=O)=N4)=N\OC)=O)=O)=O
Tpsa: 193.64
Logp: 2.2441
H Acceptors: 13
H Donors: 3
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₁₉N₅O₉S₃
Molecular Weight:
617.63
Synonyms:
None
SMILES:
OC(C1=C(CSC(C2=CC=CO2)=O)CS[C@@]3([H])N1C([C@@]3([H])NC(/C(C4=CSC(NC(C5=CC=CO5)=O)=N4)=N\OC)=O)=O)=O
Tpsa:
193.64
Logp:
2.2441
H Acceptors:
13
H Donors:
3
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₁₇N₅O₈S₃
Molecular Weight: 539.56
Synonyms: None
SMILES: OC(C(N1[C@@]2([H])[C@@](NC(/C(C3=CSC(N)=N3)=N\OC)=O)([H])C1=O)=C(CSC(C4=CC=CO4)=O)CS2=O)=O
Tpsa: 194.49
Logp: -0.0035
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:
C₁₉H₁₇N₅O₈S₃
Molecular Weight:
539.56
Synonyms:
None
SMILES:
OC(C(N1[C@@]2([H])[C@@](NC(/C(C3=CSC(N)=N3)=N\OC)=O)([H])C1=O)=C(CSC(C4=CC=CO4)=O)CS2=O)=O
Tpsa:
194.49
Logp:
-0.0035
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: C₁₆H₁₇N₅O₇S₂
Molecular Weight: 455.47
Synonyms: Claforan
SMILES: OC(C1=C(COC(C)=O)CS[C@@]([C@@H]2NC(/C(C3=CSC(N)=N3)=N/OC)=O)([H])N1C2=O)=O
Tpsa: 173.51
Logp: -0.6225
H Acceptors: 11
H Donors: 3
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₇N₅O₇S₂
Molecular Weight:
455.47
Synonyms:
Claforan
SMILES:
OC(C1=C(COC(C)=O)CS[C@@]([C@@H]2NC(/C(C3=CSC(N)=N3)=N/OC)=O)([H])N1C2=O)=O
Tpsa:
173.51
Logp:
-0.6225
H Acceptors:
11
H Donors:
3
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₀H₃₀N₁₀O₁₂S₄
Molecular Weight: 850.88
Synonyms: Cefotaxime dimer
SMILES: OC(C1=C(CNC2=NC(/C(C(N[C@H]3[C@]4([H])N(C(C(O)=O)=C(CS4)COC(C)=O)C3=O)=O)=N/OC)=CS2)CS[C@@]([C@@H]5NC(/C(C6=CSC(N)=N6)=N\OC)=O)([H])N1C5=O)=O
Tpsa: 306.73
Logp: -0.9648
H Acceptors: 20
H Donors: 6
Rotatable Bonds: 15
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₀H₃₀N₁₀O₁₂S₄
Molecular Weight:
850.88
Synonyms:
Cefotaxime dimer
SMILES:
OC(C1=C(CNC2=NC(/C(C(N[C@H]3[C@]4([H])N(C(C(O)=O)=C(CS4)COC(C)=O)C3=O)=O)=N/OC)=CS2)CS[C@@]([C@@H]5NC(/C(C6=CSC(N)=N6)=N\OC)=O)([H])N1C5=O)=O
Tpsa:
306.73
Logp:
-0.9648
H Acceptors:
20
H Donors:
6
Rotatable Bonds:
15