CS-0497587
(6R,7R)-7-((R)-5-Amino-5-carboxypentanamido)-3-(((6-hydroxy-2-methyl-5-oxo-2,5-dihydro-1,2,4-triazin-3-yl)thio)methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Ceftriaxone Impurity
Manufacturer: ChemScene
CAS Number: 473843-58-2
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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
C₁₈H₂₂N₆O₈S₂
Molecular Weight
514.53
Synonyms
Ceftriaxone Impurity 13
SMILES
O=C1N=C(SCC2=C(C(O)=O)N(C([C@@]3([H])NC(CCC[C@H](C(O)=O)N)=O)=O)[C@]3([H])SC2)N(C)N=C1O
Tpsa
218.04
Logp
-1.7062
H Acceptors
12
H Donors
5
Rotatable Bonds
10
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 473843-58-2 | | A2B Chem | -- |
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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: C₁₈H₂₂N₆O₈S₂
Molecular Weight: 514.53
Synonyms: Ceftriaxone Impurity 13
SMILES: O=C1N=C(SCC2=C(C(O)=O)N(C([C@@]3([H])NC(CCC[C@H](C(O)=O)N)=O)=O)[C@]3([H])SC2)N(C)N=C1O
Tpsa: 218.04
Logp: -1.7062
H Acceptors: 12
H Donors: 5
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:
C₁₈H₂₂N₆O₈S₂
Molecular Weight:
514.53
Synonyms:
Ceftriaxone Impurity 13
SMILES:
O=C1N=C(SCC2=C(C(O)=O)N(C([C@@]3([H])NC(CCC[C@H](C(O)=O)N)=O)=O)[C@]3([H])SC2)N(C)N=C1O
Tpsa:
218.04
Logp:
-1.7062
H Acceptors:
12
H Donors:
5
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: C₁₀H₁₆N₂O₁₀
Molecular Weight: 324.24
Synonyms: N,N'-Dioxy-aethylendiamin-N,N,N',N'-tetraessigsaeure
SMILES: O=C(CN(CC(O)=O)(CCN(CC(O)=O)(CC(O)=O)=O)=O)O
Tpsa: 195.32
Logp: -2.046
H Acceptors: 6
H Donors: 4
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:
C₁₀H₁₆N₂O₁₀
Molecular Weight:
324.24
Synonyms:
N,N'-Dioxy-aethylendiamin-N,N,N',N'-tetraessigsaeure
SMILES:
O=C(CN(CC(O)=O)(CCN(CC(O)=O)(CC(O)=O)=O)=O)O
Tpsa:
195.32
Logp:
-2.046
H Acceptors:
6
H Donors:
4
Rotatable Bonds:
11
Purity: 97%
MDL No: MFCD31560078
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₁₉N₅O₇S₂
Molecular Weight: 481.50
Synonyms: (6R,7R)-7-({(2Z)-2-(2-Amino-1,3-thiazol-4-yl)-2-[(2-ethoxy-2-oxoethoxy)imino]acetyl}amino)-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SMILES: OC(C1=C(C=C)CS[C@@]2([H])N1C([C@@]2([H])NC(/C(C3=CSC(N)=N3)=N\OCC(OCC)=O)=O)=O)=O
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
97%
MDL No:
MFCD31560078
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₉N₅O₇S₂
Molecular Weight:
481.50
Synonyms:
(6R,7R)-7-({(2Z)-2-(2-Amino-1,3-thiazol-4-yl)-2-[(2-ethoxy-2-oxoethoxy)imino]acetyl}amino)-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SMILES:
OC(C1=C(C=C)CS[C@@]2([H])N1C([C@@]2([H])NC(/C(C3=CSC(N)=N3)=N\OCC(OCC)=O)=O)=O)=O
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₁₁O₄P
Molecular Weight: 166.11
Synonyms: Phosphonic acid, [(2R,3S)-3-methyloxiranyl]-, monoethyl ester, rel- (9CI)
SMILES: C[C@@H]1O[C@@H]1[P@](O)(OCC)=O
Tpsa: 59.06
Logp: 0.9531
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₁₁O₄P
Molecular Weight:
166.11
Synonyms:
Phosphonic acid, [(2R,3S)-3-methyloxiranyl]-, monoethyl ester, rel- (9CI)
SMILES:
C[C@@H]1O[C@@H]1[P@](O)(OCC)=O
Tpsa:
59.06
Logp:
0.9531
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3