CS-0497916
(4S)-2-(Carboxy(3-(2-chloro-6-fluorophenyl)-5-methylisoxazole-4-carboxamido)methyl)-3-(2-(3-(2-chloro-6-fluorophenyl)-5-methylisoxazole-4-carboxamido)acetyl)-5,5-dimethylthiazolidine-4-carboxylic acid 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
C₃₂H₂₇Cl₂F₂N₅O₉S
Molecular Weight
766.55
Synonyms
None
SMILES
ClC1=C(C2=NOC(C)=C2C(NCC(N3C(C(C(O)=O)NC(C4=C(C)ON=C4C5=C(Cl)C=CC=C5F)=O)SC(C)(C)[C@@]3(C(O)=O)[H])=O)=O)C(F)=CC=C1
Tpsa
205.17
Logp
4.94474
H Acceptors
10
H Donors
4
Rotatable Bonds
10
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: C₃₂H₂₇Cl₂F₂N₅O₉S
Molecular Weight: 766.55
Synonyms: None
SMILES: ClC1=C(C2=NOC(C)=C2C(NCC(N3C(C(C(O)=O)NC(C4=C(C)ON=C4C5=C(Cl)C=CC=C5F)=O)SC(C)(C)[C@@]3(C(O)=O)[H])=O)=O)C(F)=CC=C1
Tpsa: 205.17
Logp: 4.94474
H Acceptors: 10
H Donors: 4
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₂H₂₇Cl₂F₂N₅O₉S
Molecular Weight:
766.55
Synonyms:
None
SMILES:
ClC1=C(C2=NOC(C)=C2C(NCC(N3C(C(C(O)=O)NC(C4=C(C)ON=C4C5=C(Cl)C=CC=C5F)=O)SC(C)(C)[C@@]3(C(O)=O)[H])=O)=O)C(F)=CC=C1
Tpsa:
205.17
Logp:
4.94474
H Acceptors:
10
H Donors:
4
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂N₂O
Molecular Weight: 200.24
Synonyms: 1-(5-methyl-2-phenyl-1H-imidazol-4-yl)ethanone
SMILES: CC(C1=C(C)N=C(C2=CC=CC=C2)N1)=O
Tpsa: 45.75
Logp: 2.58772
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₂N₂O
Molecular Weight:
200.24
Synonyms:
1-(5-methyl-2-phenyl-1H-imidazol-4-yl)ethanone
SMILES:
CC(C1=C(C)N=C(C2=CC=CC=C2)N1)=O
Tpsa:
45.75
Logp:
2.58772
H Acceptors:
2
H Donors:
1
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: C₃₈H₃₄Cl₂F₂N₆O₁₀S₂
Molecular Weight: 907.74
Synonyms: None
SMILES: O=C(O)[C@H]1C(C)(C)S[C@]([H])(C(C(O)=O)NC(C2=C(C)ON=C2C3=C(F)C=CC=C3Cl)=O)N1C([C@H]4C(C)(C)S[C@](N54)([H])[C@@](NC(C6=C(C)ON=C6C7=C(F)C=CC=C7Cl)=O)([H])C5=O)=O
Tpsa: 225.48
Logp: 5.37564
H Acceptors: 12
H Donors: 4
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₈H₃₄Cl₂F₂N₆O₁₀S₂
Molecular Weight:
907.74
Synonyms:
None
SMILES:
O=C(O)[C@H]1C(C)(C)S[C@]([H])(C(C(O)=O)NC(C2=C(C)ON=C2C3=C(F)C=CC=C3Cl)=O)N1C([C@H]4C(C)(C)S[C@](N54)([H])[C@@](NC(C6=C(C)ON=C6C7=C(F)C=CC=C7Cl)=O)([H])C5=O)=O
Tpsa:
225.48
Logp:
5.37564
H Acceptors:
12
H Donors:
4
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₂₀F₃NO₃
Molecular Weight: 283.29
Synonyms: None
SMILES: CC1(OC(F)(F)F)CCN(C(OC(C)(C)C)=O)CC1
Tpsa: 38.77
Logp: 3.3124
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₂₀F₃NO₃
Molecular Weight:
283.29
Synonyms:
None
SMILES:
CC1(OC(F)(F)F)CCN(C(OC(C)(C)C)=O)CC1
Tpsa:
38.77
Logp:
3.3124
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1