CS-0497572
(6R,7R)-7-((Z)-2-(2-Aminothiazol-4-yl)-2-(methoxyimino)acetamido)-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 5-oxide Ceftriaxone Impurity
Manufacturer: ChemScene
CAS Number: 97466-28-9
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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
C₁₈H₁₈N₈O₈S₃
Molecular Weight
570.58
Synonyms
Ceftriaxone Impurity 35
SMILES
O=C([C@H]1NC(/C(C2=CSC(N)=N2)=N\OC)=O)N([C@]1([H])S(C3)=O)C(C(O)=O)=C3CSC(N(C)N=C4O)=NC4=O
Tpsa
232.29
Logp
-2.1835
H Acceptors
15
H Donors
4
Rotatable Bonds
8
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: C₁₈H₁₈N₈O₈S₃
Molecular Weight: 570.58
Synonyms: Ceftriaxone Impurity 35
SMILES: O=C([C@H]1NC(/C(C2=CSC(N)=N2)=N\OC)=O)N([C@]1([H])S(C3)=O)C(C(O)=O)=C3CSC(N(C)N=C4O)=NC4=O
Tpsa: 232.29
Logp: -2.1835
H Acceptors: 15
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:
C₁₈H₁₈N₈O₈S₃
Molecular Weight:
570.58
Synonyms:
Ceftriaxone Impurity 35
SMILES:
O=C([C@H]1NC(/C(C2=CSC(N)=N2)=N\OC)=O)N([C@]1([H])S(C3)=O)C(C(O)=O)=C3CSC(N(C)N=C4O)=NC4=O
Tpsa:
232.29
Logp:
-2.1835
H Acceptors:
15
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: C₄H₁₁O₅P
Molecular Weight: 170.10
Synonyms: None
SMILES: CC(O)C(OC)P(O)(O)=O
Tpsa: 86.99
Logp: -0.4826
H Acceptors: 3
H Donors: 3
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:
C₄H₁₁O₅P
Molecular Weight:
170.10
Synonyms:
None
SMILES:
CC(O)C(OC)P(O)(O)=O
Tpsa:
86.99
Logp:
-0.4826
H Acceptors:
3
H Donors:
3
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: C₃H₇O₄P
Molecular Weight: 138.06
Synonyms: [(Oxiran-2-yl)methyl]phosphonic acid
SMILES: OP(CC1CO1)(O)=O
Tpsa: 70.06
Logp: -0.4371
H Acceptors: 2
H Donors: 2
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:
C₃H₇O₄P
Molecular Weight:
138.06
Synonyms:
[(Oxiran-2-yl)methyl]phosphonic acid
SMILES:
OP(CC1CO1)(O)=O
Tpsa:
70.06
Logp:
-0.4371
H Acceptors:
2
H Donors:
2
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: C₁₆H₁₇N₅O₈S₂
Molecular Weight: 471.46
Synonyms: AASJUVXHJFSORA-FNOWFJSISA-N
SMILES: O=C1C2=C(CS[C@@H](N2)C(C(O)=O)NC(/C(C3=CSC(N)=N3)=N\OCC(O)=O)=O)C(O1)C
Tpsa: 202.53
Logp: -1.0381
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:
C₁₆H₁₇N₅O₈S₂
Molecular Weight:
471.46
Synonyms:
AASJUVXHJFSORA-FNOWFJSISA-N
SMILES:
O=C1C2=C(CS[C@@H](N2)C(C(O)=O)NC(/C(C3=CSC(N)=N3)=N\OCC(O)=O)=O)C(O1)C
Tpsa:
202.53
Logp:
-1.0381
H Acceptors:
12
H Donors:
5
Rotatable Bonds:
8