CS-0497796
(6R,7R)-7-((R)-2-(Formyloxy)-2-phenylacetamido)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Cefmandole Sodium Impurity
Manufacturer: ChemScene
CAS Number: 1947364-12-6
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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
C₁₇H₁₆N₂O₆S
Molecular Weight
376.38
Synonyms
Cefamandole Impurity A
SMILES
O=C([C@@]1([H])NC([C@H](OC=O)C2=CC=CC=C2)=O)N3[C@]1([H])SCC(C)=C3C(O)=O
Tpsa
113.01
Logp
0.6592
H Acceptors
6
H Donors
2
Rotatable Bonds
6
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1947364-12-6 | (6R,7R)-7-((R)-2-(Formyloxy)-2-phenylacetamido)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Cefmandole Sodium Impurity | A2B Chem | -- |
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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: C₁₇H₁₆N₂O₆S
Molecular Weight: 376.38
Synonyms: Cefamandole Impurity A
SMILES: O=C([C@@]1([H])NC([C@H](OC=O)C2=CC=CC=C2)=O)N3[C@]1([H])SCC(C)=C3C(O)=O
Tpsa: 113.01
Logp: 0.6592
H Acceptors: 6
H Donors: 2
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:
C₁₇H₁₆N₂O₆S
Molecular Weight:
376.38
Synonyms:
Cefamandole Impurity A
SMILES:
O=C([C@@]1([H])NC([C@H](OC=O)C2=CC=CC=C2)=O)N3[C@]1([H])SCC(C)=C3C(O)=O
Tpsa:
113.01
Logp:
0.6592
H Acceptors:
6
H Donors:
2
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: C₁₄H₁₅N₅O₆S₂
Molecular Weight: 413.43
Synonyms: None
SMILES: OC(C(N(C([C@@]1([H])NC(/C(C2=CSC(N)=N2)=N\OC)=O)=O)[C@]1([H])S(C3)=O)=C3C)=O
Tpsa: 164.28
Logp: -1.1502
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:
C₁₄H₁₅N₅O₆S₂
Molecular Weight:
413.43
Synonyms:
None
SMILES:
OC(C(N(C([C@@]1([H])NC(/C(C2=CSC(N)=N2)=N\OC)=O)=O)[C@]1([H])S(C3)=O)=C3C)=O
Tpsa:
164.28
Logp:
-1.1502
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: C₁₉H₂₂N₄O₅S
Molecular Weight: 418.47
Synonyms: None
SMILES: O=C(O)[C@H]1C(C)(C)S[C@]([H])(C(C(N)=O)NC(C2=C(C)ON=C2C3=CC=CC=C3)=O)N1
Tpsa: 147.55
Logp: 1.12802
H Acceptors: 7
H Donors: 4
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:
C₁₉H₂₂N₄O₅S
Molecular Weight:
418.47
Synonyms:
None
SMILES:
O=C(O)[C@H]1C(C)(C)S[C@]([H])(C(C(N)=O)NC(C2=C(C)ON=C2C3=CC=CC=C3)=O)N1
Tpsa:
147.55
Logp:
1.12802
H Acceptors:
7
H Donors:
4
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: C₁₆H₁₆ClN₃O₄S
Molecular Weight: 381.83
Synonyms: None
SMILES: OC(C1=C(C)CS[C@@]2([H])N1C([C@@]2([H])NC([C@H](N)C3=CC=C(Cl)C=C3)=O)=O)=O
Tpsa: 112.73
Logp: 1.0983
H Acceptors: 5
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:
C₁₆H₁₆ClN₃O₄S
Molecular Weight:
381.83
Synonyms:
None
SMILES:
OC(C1=C(C)CS[C@@]2([H])N1C([C@@]2([H])NC([C@H](N)C3=CC=C(Cl)C=C3)=O)=O)=O
Tpsa:
112.73
Logp:
1.0983
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
4