CS-0498094
(6R,7R)-7-((Z)-2-(2-Aminothiazol-4-yl)-2-(methoxyimino)acetamido)-3-(((5-(carboxymethyl)-4-methylthiazol-2-yl)thio)methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 5-oxide Cefodizime 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
C₂₀H₂₀N₆O₈S₄
Molecular Weight
600.67
Synonyms
None
SMILES
OC(C(N1[C@@]2([H])[C@@](NC(/C(C3=CSC(N)=N3)=N\OC)=O)([H])C1=O)=C(CSC4=NC(C)=C(CC(O)=O)S4)CS2=O)=O
Tpsa
214.47
Logp
0.01422
H Acceptors
13
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: C₂₀H₂₀N₆O₈S₄
Molecular Weight: 600.67
Synonyms: None
SMILES: OC(C(N1[C@@]2([H])[C@@](NC(/C(C3=CSC(N)=N3)=N\OC)=O)([H])C1=O)=C(CSC4=NC(C)=C(CC(O)=O)S4)CS2=O)=O
Tpsa: 214.47
Logp: 0.01422
H Acceptors: 13
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:
C₂₀H₂₀N₆O₈S₄
Molecular Weight:
600.67
Synonyms:
None
SMILES:
OC(C(N1[C@@]2([H])[C@@](NC(/C(C3=CSC(N)=N3)=N\OC)=O)([H])C1=O)=C(CSC4=NC(C)=C(CC(O)=O)S4)CS2=O)=O
Tpsa:
214.47
Logp:
0.01422
H Acceptors:
13
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: C₁₄H₁₅N₃O₅S₃
Molecular Weight: 401.48
Synonyms: 7-amino-3-((5-carboxymethyl-4-methyl-1,3-thiazol-2-ylthio)methyl)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid
SMILES: OC(C1=C(CSC2=NC(C)=C(CC(O)=O)S2)CS[C@@]3([H])N1C([C@@]3([H])N)=O)=O
Tpsa: 133.82
Logp: 0.75182
H Acceptors: 8
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:
C₁₄H₁₅N₃O₅S₃
Molecular Weight:
401.48
Synonyms:
7-amino-3-((5-carboxymethyl-4-methyl-1,3-thiazol-2-ylthio)methyl)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid
SMILES:
OC(C1=C(CSC2=NC(C)=C(CC(O)=O)S2)CS[C@@]3([H])N1C([C@@]3([H])N)=O)=O
Tpsa:
133.82
Logp:
0.75182
H Acceptors:
8
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: C₂₂H₂₉N₅O₉S₂
Molecular Weight: 571.62
Synonyms: None
SMILES: CS(N(C1=O)CCN1C(N[C@@](C2=CC=CC=C2)([H])C(N[C@@H](C(OC)=O)[C@@]3([H])SC(C)(C)[C@@](C(O)=O)([H])N3)=O)=O)(=O)=O
Tpsa: 191.52
Logp: -0.3134
H Acceptors: 10
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:
C₂₂H₂₉N₅O₉S₂
Molecular Weight:
571.62
Synonyms:
None
SMILES:
CS(N(C1=O)CCN1C(N[C@@](C2=CC=CC=C2)([H])C(N[C@@H](C(OC)=O)[C@@]3([H])SC(C)(C)[C@@](C(O)=O)([H])N3)=O)=O)(=O)=O
Tpsa:
191.52
Logp:
-0.3134
H Acceptors:
10
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: C₂₄H₃₀N₄O₁₀S₂
Molecular Weight: 598.65
Synonyms: None
SMILES: CS(N(C1=O)CCN1C(N[C@@](C2=CC=CC=C2)([H])C(CC(C(O)=O)C3N(C(C)=O)[C@H](C(O)=O)C(C)(C)S3)=O)=O)(=O)=O
Tpsa: 198.77
Logp: 0.9477
H Acceptors: 9
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:
C₂₄H₃₀N₄O₁₀S₂
Molecular Weight:
598.65
Synonyms:
None
SMILES:
CS(N(C1=O)CCN1C(N[C@@](C2=CC=CC=C2)([H])C(CC(C(O)=O)C3N(C(C)=O)[C@H](C(O)=O)C(C)(C)S3)=O)=O)(=O)=O
Tpsa:
198.77
Logp:
0.9477
H Acceptors:
9
H Donors:
3
Rotatable Bonds:
9