CS-0498033
(2S,5R,6R)-4-Methoxybenzyl 3,3-dimethyl-7-oxo-6-(2-phenylacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate 4-oxide Penicillin 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
C₂₄H₂₆N₂O₆S
Molecular Weight
470.54
Synonyms
None
SMILES
O=C1[C@H]([C@]2([H])N1[C@@H](C(OCC3=CC=C(OC)C=C3)=O)C(C)(C)S2=O)NC(CC4=CC=CC=C4)=O
Tpsa
102.01
Logp
1.5437
H Acceptors
6
H Donors
1
Rotatable Bonds
7
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: C₂₄H₂₆N₂O₆S
Molecular Weight: 470.54
Synonyms: None
SMILES: O=C1[C@H]([C@]2([H])N1[C@@H](C(OCC3=CC=C(OC)C=C3)=O)C(C)(C)S2=O)NC(CC4=CC=CC=C4)=O
Tpsa: 102.01
Logp: 1.5437
H Acceptors: 6
H Donors: 1
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:
C₂₄H₂₆N₂O₆S
Molecular Weight:
470.54
Synonyms:
None
SMILES:
O=C1[C@H]([C@]2([H])N1[C@@H](C(OCC3=CC=C(OC)C=C3)=O)C(C)(C)S2=O)NC(CC4=CC=CC=C4)=O
Tpsa:
102.01
Logp:
1.5437
H Acceptors:
6
H Donors:
1
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: C₁₅H₁₇N₅O₆S₂
Molecular Weight: 427.46
Synonyms: None
SMILES: OC(C1=C(COC)CS[C@@]2([H])N1C([C@@]2([H])NC(/C(C3=CSC(N)=N3)=N/OC)=O)=O)=O
Tpsa: 156.44
Logp: -0.5392
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:
C₁₅H₁₇N₅O₆S₂
Molecular Weight:
427.46
Synonyms:
None
SMILES:
OC(C1=C(COC)CS[C@@]2([H])N1C([C@@]2([H])NC(/C(C3=CSC(N)=N3)=N/OC)=O)=O)=O
Tpsa:
156.44
Logp:
-0.5392
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: C₁₅H₁₇N₅O₇S₂
Molecular Weight: 443.45
Synonyms: None
SMILES: OC(C(N1[C@@]2([H])[C@@](NC(/C(C3=CSC(N)=N3)=N\OC)=O)([H])C1=O)=C(COC)CS2=O)=O
Tpsa: 173.51
Logp: -1.5237
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:
C₁₅H₁₇N₅O₇S₂
Molecular Weight:
443.45
Synonyms:
None
SMILES:
OC(C(N1[C@@]2([H])[C@@](NC(/C(C3=CSC(N)=N3)=N\OC)=O)([H])C1=O)=C(COC)CS2=O)=O
Tpsa:
173.51
Logp:
-1.5237
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: C₅H₆N₄O₂S
Molecular Weight: 186.19
Synonyms: Cefdinir Impurity 15 (Cefdinir CP Impurity A)
SMILES: NC(/C(C1=CSC(N)=N1)=N\O)=O
Tpsa: 114.59
Logp: -0.6111
H Acceptors: 6
H Donors: 3
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:
C₅H₆N₄O₂S
Molecular Weight:
186.19
Synonyms:
Cefdinir Impurity 15 (Cefdinir CP Impurity A)
SMILES:
NC(/C(C1=CSC(N)=N1)=N\O)=O
Tpsa:
114.59
Logp:
-0.6111
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
2