CS-0380862
(6R,7R)-7-((Z)-2-(Furan-2-yl)-2-(methoxyimino)acetamido)-8-oxo-3-((((2,2,2-trichloroacetyl)carbamoyl)oxy)methyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Cefuroxime Impurity
Manufacturer: ChemScene
CAS Number: 76598-06-6
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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
C₁₈H₁₅Cl₃N₄O₉S
Molecular Weight
569.76
Synonyms
N-(2,2,2-Trichloroacetyl)cefuroxime
SMILES
OC(C1=C(COC(NC(C(Cl)(Cl)Cl)=O)=O)CS[C@@]([C@@H]2NC(/C(C3=CC=CO3)=N\OC)=O)([H])N1C2=O)=O
Tpsa
176.84
Logp
0.9917
H Acceptors
10
H Donors
3
Rotatable Bonds
7
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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: C₁₈H₁₅Cl₃N₄O₉S
Molecular Weight: 569.76
Synonyms: N-(2,2,2-Trichloroacetyl)cefuroxime
SMILES: OC(C1=C(COC(NC(C(Cl)(Cl)Cl)=O)=O)CS[C@@]([C@@H]2NC(/C(C3=CC=CO3)=N\OC)=O)([H])N1C2=O)=O
Tpsa: 176.84
Logp: 0.9917
H Acceptors: 10
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:
C₁₈H₁₅Cl₃N₄O₉S
Molecular Weight:
569.76
Synonyms:
N-(2,2,2-Trichloroacetyl)cefuroxime
SMILES:
OC(C1=C(COC(NC(C(Cl)(Cl)Cl)=O)=O)CS[C@@]([C@@H]2NC(/C(C3=CC=CO3)=N\OC)=O)([H])N1C2=O)=O
Tpsa:
176.84
Logp:
0.9917
H Acceptors:
10
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: C₁₀H₁₁N₅O₃S₂
Molecular Weight: 313.36
Synonyms: (6S,7S)-7-Amino-8-oxo-3-[(1H-1,2,3-triazol-4-ylsulfanyl)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SMILES: OC(C1=C(CSC2=CN=NN2)CS[C@@]([C@@H]3N)([H])N1C3=O)=O
Tpsa: 125.2
Logp: -0.5221
H Acceptors: 7
H Donors: 3
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₁N₅O₃S₂
Molecular Weight:
313.36
Synonyms:
(6S,7S)-7-Amino-8-oxo-3-[(1H-1,2,3-triazol-4-ylsulfanyl)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SMILES:
OC(C1=C(CSC2=CN=NN2)CS[C@@]([C@@H]3N)([H])N1C3=O)=O
Tpsa:
125.2
Logp:
-0.5221
H Acceptors:
7
H Donors:
3
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₂N₂O₄S₂
Molecular Weight: 336.39
Synonyms: Cefalonium Impurity C
SMILES: O=C1N2C3=C(CS[C@]2([H])[C@@H]1NC(CC4=CC=CS4)=O)COC3=O
Tpsa: 75.71
Logp: 0.5014
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₂N₂O₄S₂
Molecular Weight:
336.39
Synonyms:
Cefalonium Impurity C
SMILES:
O=C1N2C3=C(CS[C@]2([H])[C@@H]1NC(CC4=CC=CS4)=O)COC3=O
Tpsa:
75.71
Logp:
0.5014
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₃N₃O₆S
Molecular Weight: 363.35
Synonyms: Descarbamoylcefuroxime lactone
SMILES: O=C1N2[C@@](SCC3=C2C(OC3)=O)([H])[C@@H]1NC(/C(C4=CC=CO4)=N\OC)=O
Tpsa: 110.44
Logp: -0.1591
H Acceptors: 8
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₃N₃O₆S
Molecular Weight:
363.35
Synonyms:
Descarbamoylcefuroxime lactone
SMILES:
O=C1N2[C@@](SCC3=C2C(OC3)=O)([H])[C@@H]1NC(/C(C4=CC=CO4)=N\OC)=O
Tpsa:
110.44
Logp:
-0.1591
H Acceptors:
8
H Donors:
1
Rotatable Bonds:
4