CS-0497830
(2S,5R,6R)-Ethyl 6-(3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Cloxacillin 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
C₂₁H₂₂ClN₃O₅S
Molecular Weight
463.93
Synonyms
None
SMILES
O=C(OCC)[C@H]1C(C)(C)S[C@](N21)([H])[C@@](NC(C3=C(C)ON=C3C4=CC=CC=C4Cl)=O)([H])C2=O
Tpsa
101.74
Logp
3.02722
H Acceptors
7
H Donors
1
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: C₂₁H₂₂ClN₃O₅S
Molecular Weight: 463.93
Synonyms: None
SMILES: O=C(OCC)[C@H]1C(C)(C)S[C@](N21)([H])[C@@](NC(C3=C(C)ON=C3C4=CC=CC=C4Cl)=O)([H])C2=O
Tpsa: 101.74
Logp: 3.02722
H Acceptors: 7
H Donors: 1
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:
C₂₁H₂₂ClN₃O₅S
Molecular Weight:
463.93
Synonyms:
None
SMILES:
O=C(OCC)[C@H]1C(C)(C)S[C@](N21)([H])[C@@](NC(C3=C(C)ON=C3C4=CC=CC=C4Cl)=O)([H])C2=O
Tpsa:
101.74
Logp:
3.02722
H Acceptors:
7
H Donors:
1
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: C₁₉H₁₉ClN₄O₄S
Molecular Weight: 434.90
Synonyms: None
SMILES: O=C(N)[C@H]1C(C)(C)S[C@](N21)([H])[C@@](NC(C3=C(C)ON=C3C4=CC=CC=C4Cl)=O)([H])C2=O
Tpsa: 118.53
Logp: 1.94942
H Acceptors: 6
H Donors: 2
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:
C₁₉H₁₉ClN₄O₄S
Molecular Weight:
434.90
Synonyms:
None
SMILES:
O=C(N)[C@H]1C(C)(C)S[C@](N21)([H])[C@@](NC(C3=C(C)ON=C3C4=CC=CC=C4Cl)=O)([H])C2=O
Tpsa:
118.53
Logp:
1.94942
H Acceptors:
6
H Donors:
2
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: C₂₇H₂₇ClFN₅O₇S₂
Molecular Weight: 652.11
Synonyms: None
SMILES: O=C1[C@](NC(C2=C(C)ON=C2C3=C(F)C=CC=C3Cl)=O)([H])[C@]4([H])N1[C@](C(N[C@]([C@]5([H])N6[C@@]([H])(C(O)=O)C(C)(C)S5)([H])C6=O)=O)([H])C(C)(C)S4
Tpsa: 162.15
Logp: 2.23492
H Acceptors: 9
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:
C₂₇H₂₇ClFN₅O₇S₂
Molecular Weight:
652.11
Synonyms:
None
SMILES:
O=C1[C@](NC(C2=C(C)ON=C2C3=C(F)C=CC=C3Cl)=O)([H])[C@]4([H])N1[C@](C(N[C@]([C@]5([H])N6[C@@]([H])(C(O)=O)C(C)(C)S5)([H])C6=O)=O)([H])C(C)(C)S4
Tpsa:
162.15
Logp:
2.23492
H Acceptors:
9
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: C₁₃H₁₄N₄O₄S₂
Molecular Weight: 354.40
Synonyms: None
SMILES: O=C1N2C(C(O)=O)=C(C)CS[C@]2([H])[C@@]1(NC(CC3=CSC(N)=N3)=O)[H]
Tpsa: 125.62
Logp: 0.0263
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:
C₁₃H₁₄N₄O₄S₂
Molecular Weight:
354.40
Synonyms:
None
SMILES:
O=C1N2C(C(O)=O)=C(C)CS[C@]2([H])[C@@]1(NC(CC3=CSC(N)=N3)=O)[H]
Tpsa:
125.62
Logp:
0.0263
H Acceptors:
7
H Donors:
3
Rotatable Bonds:
4