CS-0498052
(6R,7R)-7-((Z)-2-(2-Aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid Ceftizoxime 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
C₁₃H₁₃N₅O₅S₂
Molecular Weight
383.40
Synonyms
None
SMILES
O=C1[C@@]([H])(NC(/C(C2=CSC(N)=N2)=N\OC)=O)[C@](SC=C3)([H])N1C3C(O)=O
Tpsa
147.21
Logp
-0.5574
H Acceptors
9
H Donors
3
Rotatable Bonds
5
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: C₁₃H₁₃N₅O₅S₂
Molecular Weight: 383.40
Synonyms: None
SMILES: O=C1[C@@]([H])(NC(/C(C2=CSC(N)=N2)=N\OC)=O)[C@](SC=C3)([H])N1C3C(O)=O
Tpsa: 147.21
Logp: -0.5574
H Acceptors: 9
H Donors: 3
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₃N₅O₅S₂
Molecular Weight:
383.40
Synonyms:
None
SMILES:
O=C1[C@@]([H])(NC(/C(C2=CSC(N)=N2)=N\OC)=O)[C@](SC=C3)([H])N1C3C(O)=O
Tpsa:
147.21
Logp:
-0.5574
H Acceptors:
9
H Donors:
3
Rotatable Bonds:
5
Purity: 98%
MDL No: MFCD28898443
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₀N₂O₆S
Molecular Weight: 368.40
Synonyms: Penicilloic V acid
SMILES: O=C(C(C1SC(C)(C(C(O)=O)N1)C)NC(COC2=CC=CC=C2)=O)O
Tpsa: 124.96
Logp: 0.5291
H Acceptors: 6
H Donors: 4
Rotatable Bonds: 7
Purity:
98%
MDL No:
MFCD28898443
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₀N₂O₆S
Molecular Weight:
368.40
Synonyms:
Penicilloic V acid
SMILES:
O=C(C(C1SC(C)(C(C(O)=O)N1)C)NC(COC2=CC=CC=C2)=O)O
Tpsa:
124.96
Logp:
0.5291
H Acceptors:
6
H Donors:
4
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: C₁₃H₁₃N₅O₅S₂
Molecular Weight: 383.40
Synonyms: (6R,7S)-7-((Z)-2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SMILES: O=C1[C@]([H])(NC(/C(C2=CSC(N)=N2)=N\OC)=O)[C@]3([H])N1C(C(O)=O)=CCS3
Tpsa: 147.21
Logp: -0.5558
H Acceptors: 9
H Donors: 3
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₃N₅O₅S₂
Molecular Weight:
383.40
Synonyms:
(6R,7S)-7-((Z)-2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SMILES:
O=C1[C@]([H])(NC(/C(C2=CSC(N)=N2)=N\OC)=O)[C@]3([H])N1C(C(O)=O)=CCS3
Tpsa:
147.21
Logp:
-0.5558
H Acceptors:
9
H Donors:
3
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₀N₂O₄S
Molecular Weight: 324.40
Synonyms: 5,5-dimethyl-2-[[(2-phenoxyacetyl)amino]methyl]-1,3-thiazolidine-4-carboxylic Acid
SMILES: O=C(C1NC(CNC(COC2=CC=CC=C2)=O)SC1(C)C)O
Tpsa: 87.66
Logp: 1.0759
H Acceptors: 5
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:
C₁₅H₂₀N₂O₄S
Molecular Weight:
324.40
Synonyms:
5,5-dimethyl-2-[[(2-phenoxyacetyl)amino]methyl]-1,3-thiazolidine-4-carboxylic Acid
SMILES:
O=C(C1NC(CNC(COC2=CC=CC=C2)=O)SC1(C)C)O
Tpsa:
87.66
Logp:
1.0759
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
6