CS-0498071
(2S,5R,6R)-3,3-Dimethyl-6-((R)-2-((2S,5R,6R)-6-((R)-2-(3-(methylsulfonyl)-2-oxoimidazolidine-1-carboxamido)-2-phenylacetamido)-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxamido)-2-phenylacetamido)-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Mezlocillin 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
C₃₅H₃₈N₈O₁₁S₃
Molecular Weight
842.92
Synonyms
None
SMILES
CC([C@]1([H])C(O)=O)(C)S[C@@]2([H])N1C([C@@]2([H])NC([C@@](NC([C@]3([H])N(C([C@@]4([H])NC([C@@](NC(N5CCN(S(C)(=O)=O)C5=O)=O)([H])C6=CC=CC=C6)=O)=O)[C@]4([H])SC3)=O)([H])C7=CC=CC=C7)=O)=O
Tpsa
252.01
Logp
-0.6078
H Acceptors
12
H Donors
5
Rotatable Bonds
11
Other Options
...
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SAFETY INFORMATION
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: C₃₅H₃₈N₈O₁₁S₃
Molecular Weight: 842.92
Synonyms: None
SMILES: CC([C@]1([H])C(O)=O)(C)S[C@@]2([H])N1C([C@@]2([H])NC([C@@](NC([C@]3([H])N(C([C@@]4([H])NC([C@@](NC(N5CCN(S(C)(=O)=O)C5=O)=O)([H])C6=CC=CC=C6)=O)=O)[C@]4([H])SC3)=O)([H])C7=CC=CC=C7)=O)=O
Tpsa: 252.01
Logp: -0.6078
H Acceptors: 12
H Donors: 5
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₅H₃₈N₈O₁₁S₃
Molecular Weight:
842.92
Synonyms:
None
SMILES:
CC([C@]1([H])C(O)=O)(C)S[C@@]2([H])N1C([C@@]2([H])NC([C@@](NC([C@]3([H])N(C([C@@]4([H])NC([C@@](NC(N5CCN(S(C)(=O)=O)C5=O)=O)([H])C6=CC=CC=C6)=O)=O)[C@]4([H])SC3)=O)([H])C7=CC=CC=C7)=O)=O
Tpsa:
252.01
Logp:
-0.6078
H Acceptors:
12
H Donors:
5
Rotatable Bonds:
11
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₆H₂₄N₁₀O₉S₄
Molecular Weight: 748.79
Synonyms: None
SMILES: O=C1[C@@]([H])(NC(/C(C2=CSC(NC(C3=CCS[C@@]4([H])N3C([C@]4(NC(/C(C5=CSC(N)=N5)=N\OC)=O)[H])=O)=O)=N2)=N\OC)=O)[C@]6([H])N1C(C(O)=O)=CCS6
Tpsa: 260.2
Logp: -0.8263
H Acceptors: 17
H Donors: 5
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₆H₂₄N₁₀O₉S₄
Molecular Weight:
748.79
Synonyms:
None
SMILES:
O=C1[C@@]([H])(NC(/C(C2=CSC(NC(C3=CCS[C@@]4([H])N3C([C@]4(NC(/C(C5=CSC(N)=N5)=N\OC)=O)[H])=O)=O)=N2)=N\OC)=O)[C@]6([H])N1C(C(O)=O)=CCS6
Tpsa:
260.2
Logp:
-0.8263
H Acceptors:
17
H Donors:
5
Rotatable Bonds:
11
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₃H₂₁N₇O₇S₃
Molecular Weight: 603.65
Synonyms: None
SMILES: [H][C@@]1(NC(/C(C2=CSC(N)=N2)=N\O)=O)C(N3[C@]1([H])SCC(C=C)=C3C(N[C@]4([H])C(N5[C@]4([H])SCC(C=C)=C5C(O)=O)=O)=O)=O
Tpsa: 207.62
Logp: -0.3318
H Acceptors: 12
H Donors: 5
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:
C₂₃H₂₁N₇O₇S₃
Molecular Weight:
603.65
Synonyms:
None
SMILES:
[H][C@@]1(NC(/C(C2=CSC(N)=N2)=N\O)=O)C(N3[C@]1([H])SCC(C=C)=C3C(N[C@]4([H])C(N5[C@]4([H])SCC(C=C)=C5C(O)=O)=O)=O)=O
Tpsa:
207.62
Logp:
-0.3318
H Acceptors:
12
H Donors:
5
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: C₂₉H₃₅N₇O₁₀S₃
Molecular Weight: 737.82
Synonyms: None
SMILES: CS(N(C1=O)CCN1C(N[C@@](C2=CC=CC=C2)([H])C(N[C@]3([H])C(N([C@]3([H])SC4(C)C)[C@@]4([H])C(N[C@@]5([H])[C@](SC(C)(C)[C@]6([H])C(O)=O)([H])N6C5=O)=O)=O)=O)=O)(=O)=O
Tpsa: 222.91
Logp: -0.6867
H Acceptors: 11
H Donors: 4
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:
C₂₉H₃₅N₇O₁₀S₃
Molecular Weight:
737.82
Synonyms:
None
SMILES:
CS(N(C1=O)CCN1C(N[C@@](C2=CC=CC=C2)([H])C(N[C@]3([H])C(N([C@]3([H])SC4(C)C)[C@@]4([H])C(N[C@@]5([H])[C@](SC(C)(C)[C@]6([H])C(O)=O)([H])N6C5=O)=O)=O)=O)=O)(=O)=O
Tpsa:
222.91
Logp:
-0.6867
H Acceptors:
11
H Donors:
4
Rotatable Bonds:
8