CS-0497693
(6R,7R)-7-((R)-2-Amino-2-(cyclohexa-1,4-dien-1-yl)acetamido)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 5-oxide Cefradine Impurity
Manufacturer: ChemScene
CAS Number: 2111133-51-6
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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
C₁₆H₁₉N₃O₅S
Molecular Weight
365.40
Synonyms
Cefradine oxide D
SMILES
CC1=C(C(O)=O)N(C([C@]2(NC([C@H](N)C3=CCC=CC3)=O)[H])=O)[C@]2([H])S(C1)=O
Tpsa
129.8
Logp
-0.6359
H Acceptors
5
H Donors
3
Rotatable Bonds
4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 2111133-51-6 | CEFRADINE OXIDE D | 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: C₁₆H₁₉N₃O₅S
Molecular Weight: 365.40
Synonyms: Cefradine oxide D
SMILES: CC1=C(C(O)=O)N(C([C@]2(NC([C@H](N)C3=CCC=CC3)=O)[H])=O)[C@]2([H])S(C1)=O
Tpsa: 129.8
Logp: -0.6359
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₉N₃O₅S
Molecular Weight:
365.40
Synonyms:
Cefradine oxide D
SMILES:
CC1=C(C(O)=O)N(C([C@]2(NC([C@H](N)C3=CCC=CC3)=O)[H])=O)[C@]2([H])S(C1)=O
Tpsa:
129.8
Logp:
-0.6359
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₃ClF₃NO
Molecular Weight: 255.66
Synonyms: None
SMILES: FC(F)(OC1=CC=C(C(CC)N)C=C1)F.Cl
Tpsa: 35.25
Logp: 3.4168
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₃ClF₃NO
Molecular Weight:
255.66
Synonyms:
None
SMILES:
FC(F)(OC1=CC=C(C(CC)N)C=C1)F.Cl
Tpsa:
35.25
Logp:
3.4168
H Acceptors:
2
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: C₁₆H₂₁N₃O₈S
Molecular Weight: 415.42
Synonyms: None
SMILES: OC(C1=C(COC(C)=O)CS[C@@]2([H])N1C([C@@]2([H])NC(CCC[C@H](N)C(O)=O)=O)=O)=O
Tpsa: 176.33
Logp: -1.1297
H Acceptors: 8
H Donors: 4
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:
C₁₆H₂₁N₃O₈S
Molecular Weight:
415.42
Synonyms:
None
SMILES:
OC(C1=C(COC(C)=O)CS[C@@]2([H])N1C([C@@]2([H])NC(CCC[C@H](N)C(O)=O)=O)=O)=O
Tpsa:
176.33
Logp:
-1.1297
H Acceptors:
8
H Donors:
4
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₃BrN₂
Molecular Weight: 265.15
Synonyms: None
SMILES: BrC1=CN(C2=CC=C(C(C)C)C=C2)N=C1
Tpsa: 17.82
Logp: 3.7582
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₃BrN₂
Molecular Weight:
265.15
Synonyms:
None
SMILES:
BrC1=CN(C2=CC=C(C(C)C)C=C2)N=C1
Tpsa:
17.82
Logp:
3.7582
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2