CS-0497880
(6R,7R)-7-((S)-5-Amino-5-carboxypentanamido)-3-((1-methylpyrrolidin-1-ium-1-yl)methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Cefepime 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
C₁₉H₂₈N₄O₆S
Molecular Weight
440.51
Synonyms
None
SMILES
O=C(N[C@]1([H])C(N2[C@]1([H])SCC(C[N+]3(C)CCCC3)=C2C([O-])=O)=O)CCC[C@H](N)C(O)=O
Tpsa
152.86
Logp
-1.7871
H Acceptors
7
H Donors
3
Rotatable Bonds
9
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: C₁₉H₂₈N₄O₆S
Molecular Weight: 440.51
Synonyms: None
SMILES: O=C(N[C@]1([H])C(N2[C@]1([H])SCC(C[N+]3(C)CCCC3)=C2C([O-])=O)=O)CCC[C@H](N)C(O)=O
Tpsa: 152.86
Logp: -1.7871
H Acceptors: 7
H Donors: 3
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₈N₄O₆S
Molecular Weight:
440.51
Synonyms:
None
SMILES:
O=C(N[C@]1([H])C(N2[C@]1([H])SCC(C[N+]3(C)CCCC3)=C2C([O-])=O)=O)CCC[C@H](N)C(O)=O
Tpsa:
152.86
Logp:
-1.7871
H Acceptors:
7
H Donors:
3
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₂ClNO₂
Molecular Weight: 225.67
Synonyms: None
SMILES: COC([C@@H]1CC2=CC=C(Cl)C=C2CN1)=O
Tpsa: 38.33
Logp: 1.5273
H Acceptors: 3
H Donors: 1
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:
C₁₁H₁₂ClNO₂
Molecular Weight:
225.67
Synonyms:
None
SMILES:
COC([C@@H]1CC2=CC=C(Cl)C=C2CN1)=O
Tpsa:
38.33
Logp:
1.5273
H Acceptors:
3
H Donors:
1
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: C₁₈H₁₅Cl₂N₅O₅S₃
Molecular Weight: 548.44
Synonyms: None
SMILES: ClC1=CN(CC(N[C@]2([H])[C@](SCC(CSC3=NN=C(C)S3)=C4C(O)=O)([H])N4C2=O)=O)C=C(Cl)C1=O
Tpsa: 134.49
Logp: 1.84592
H Acceptors: 10
H Donors: 2
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:
C₁₈H₁₅Cl₂N₅O₅S₃
Molecular Weight:
548.44
Synonyms:
None
SMILES:
ClC1=CN(CC(N[C@]2([H])[C@](SCC(CSC3=NN=C(C)S3)=C4C(O)=O)([H])N4C2=O)=O)C=C(Cl)C1=O
Tpsa:
134.49
Logp:
1.84592
H Acceptors:
10
H Donors:
2
Rotatable Bonds:
7
Purity: 95%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₆N₂O₅S
Molecular Weight: 312.34
Synonyms: 3-[(4-Acetylpiperazin-1-yl)sulfonyl]benzoic acid
SMILES: O=C(O)C1=CC=CC(S(=O)(N2CCN(C(C)=O)CC2)=O)=C1
Tpsa: 94.99
Logp: 0.2376
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₆N₂O₅S
Molecular Weight:
312.34
Synonyms:
3-[(4-Acetylpiperazin-1-yl)sulfonyl]benzoic acid
SMILES:
O=C(O)C1=CC=CC(S(=O)(N2CCN(C(C)=O)CC2)=O)=C1
Tpsa:
94.99
Logp:
0.2376
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3