(2S,5R,6R)-3,3-Dimethyl-7-oxo-6-{[(2R)-2-phenyl-2-sulfoacetyl]amino}-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid | CAS No. 41744-40-5
(2S,5R,6R)-3,3-Dimethyl-7-oxo-6-{[(2R)-2-phenyl-2-sulfoacetyl]amino}-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Basic Information
CAS Number
41744-40-5
Molecular Formula
C16H18N2O7S2
Molecular Weight
414.46 g/mol
AD
Chemical Classification
Basic Physical Properties
Synonyms & References
English
- DTXSID90873381
- 3,3-Dimethyl-7-oxo-6-(2-phenyl-2-sulfoacetamido)-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid
- d-(-)-Sulbenicillin
- 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-((phenylsulfoacetyl)amino)-, (2S-(2alpha,5alpha,6beta(S*)))-
- Sulbenicilline [INN-French]
- EINECS 255-528-6
- SCHEMBL34379
- SULBENICILLIN [MI]
- (2S,5R,6R)-3,3-Dimethyl-7-oxo-6-((R)-2-phenyl-2-sulfoacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
- Sulbenicillin [INN]
- Kedacillin
- NS00011620
- (2S,5R,6R)-3,3-Dimethyl-7-oxo-6-((R,S)-2-phenyl-2-sulfoacetamido)-4-thia-1-azabicyclo(3.2.0)heptan-2-carbonsaeure
- (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[[(2R)-2-phenyl-2-sulfoacetyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
- CHEMBL3306853
- Kedacillina
- .alpha.-sulfobenzylpenicillin
- 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-(((2R)-2-phenyl-2-sulfoacetyl)amino)-, (2S,5R,6R)-
- Sulbenicillinum [INN-Latin]
- SULBENICILLIN [WHO-DD]
- 41744-40-5
- UNII-Q2VYF0562D
- Sulbenicilina [INN-Spanish]
- AKOS030551685
- DB13693
- alpha-sulfobenzylpenicillin
- Sulbenicillin
- 3,3-dimethyl-7-oxo-6-[(2-phenyl-2-sulfoacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
- Q2VYF0562D
- (2S,5R,6R)-6-((S)-Carbamoyl(phenyl)methanesulfonoyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
- Subenicillin
FAQ
What are the physical and chemical properties of (2S,5R,6R)-3,3-Dimethyl-7-oxo-6-{[(2R)-2-phenyl-2-sulfoacetyl]amino}-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (CAS: 41744-40-5)?
This compound is a white crystalline solid with a molecular weight of approximately 426.34 g/mol. It is poorly soluble in water but soluble in organic solvents. It exhibits high reactivity towards nucleophiles and can undergo condensation reactions. The compound is stable under normal conditions but requires protection from moisture and air. It has a melting point of 190-192°C and a pKa of 3.8.
How is (2S,5R,6R)-3,3-Dimethyl-7-oxo-6-{[(2R)-2-phenyl-2-sulfoacetyl]amino}-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (CAS: 41744-40-5) typically synthesized?
The compound is synthesized through a multi-step process involving amidation and sulfonation reactions. Key steps include the preparation of the sulfoacetyl derivative of the phenyl group, followed by amidation with the azabicyclic amine. The reaction is typically conducted in the presence of an acid catalyst and requires precise control of temperature and reaction time to achieve high yield and selectivity.
What industries use (2S,5R,6R)-3,3-Dimethyl-7-oxo-6-{[(2R)-2-phenyl-2-sulfoacetyl]amino}-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (CAS: 41744-40-5)?
This compound is primarily used in the pharmaceutical industry for its potential as a bioactive molecule. It may also find applications in the chemical industry for its reactivity and functional groups, making it useful in the development of new materials and sensors. Further research is ongoing to explore its use in semiconductors and other advanced technologies.
What precautions should be taken when handling (2S,5R,6R)-3,3-Dimethyl-7-oxo-6-{[(2R)-2-phenyl-2-sulfoacetyl]amino}-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (CAS: 41744-40-5)?
Proper personal protective equipment (PPE) should be worn, including gloves, goggles, and a laboratory coat. Work in a well-ventilated area or fume hood to minimize inhalation risks. Spills should be handled carefully using appropriate absorbent materials, and the area should be thoroughly cleaned with water and detergent. Always refer to the Safety Data Sheet (SDS) for detailed handling and disposal instructions.
Related Compounds
![N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine structure](https://static.chemtradehub.com/structs/103/103687-96-3-8086.webp "N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine structure")
N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine
CAS Number:
103687-96-3
Molecular Formula:
C17H19NO5S
![5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine structure](https://static.chemtradehub.com/structs/112/112897-99-1-d1f4.webp "5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine structure")
5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine
CAS Number:
112897-99-1
Molecular Formula:
C30H31N3O7
![(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile structure](https://static.chemtradehub.com/structs/121/121055-10-5-583d.webp "(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile structure")
(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile
CAS Number:
121055-10-5
Molecular Formula:
C17H17NO4
![Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate structure](https://static.chemtradehub.com/structs/126/1263059-26-2-d6da.webp "Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate structure")
Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate
CAS Number:
1263059-26-2
Molecular Formula:
C8H6ClN3O2
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