5-methyl-2-{[(4-{[4-(4-nitrophenyl)piperazin-1-yl]carbonyl}-1,3-thiazol-2-yl)methyl]sulfanyl}-1,3-benzoxazole is a complex organic compound with a molecular formula of C22H20N6O4S2. It features a benzoxazole core, which is a heterocyclic aromatic ring system consisting of a benzene ring fused to an oxazole ring. The compound is characterized by a methyl group at the 5-position, a sulfanyl group at the 2-position, and a substituted 1,3-thiazole ring attached to the benzoxazole through a methylene bridge. The thiazole ring is further substituted with a 4-nitrophenyl group and a piperazine ring, which is itself carbonylated. This molecule is a potential pharmaceutical candidate due to its intricate structure and the presence of various functional groups that can interact with biological targets.
5955-78-2
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Basic information
- Product Name: 5-methyl-2-{[(4-{[4-(4-nitrophenyl)piperazin-1-yl]carbonyl}-1,3-thiazol-2-yl)methyl]sulfanyl}-1,3-benzoxazole
- Synonyms:
- CAS NO:5955-78-2
- Molecular Formula: C9H9NOS
- Molecular Weight: 495.5739
- EINECS: N/A
- Product Categories: N/A
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Chemical Properties
- Melting Point: N/A
- Boiling Point: 728.8°C at 760 mmHg
- Flash Point: 394.5°C
- Appearance: N/A
- Density: 1.5g/cm3
- Vapor Pressure: 4.28E-21mmHg at 25°C
- Refractive Index: 1.733
- Storage Temp.: N/A
- Solubility: N/A
- CAS DataBase Reference: 5-methyl-2-{[(4-{[4-(4-nitrophenyl)piperazin-1-yl]carbonyl}-1,3-thiazol-2-yl)methyl]sulfanyl}-1,3-benzoxazole(CAS DataBase Reference)
- NIST Chemistry Reference: 5-methyl-2-{[(4-{[4-(4-nitrophenyl)piperazin-1-yl]carbonyl}-1,3-thiazol-2-yl)methyl]sulfanyl}-1,3-benzoxazole(5955-78-2)
- EPA Substance Registry System: 5-methyl-2-{[(4-{[4-(4-nitrophenyl)piperazin-1-yl]carbonyl}-1,3-thiazol-2-yl)methyl]sulfanyl}-1,3-benzoxazole(5955-78-2)
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Safety Data
- Hazard Codes: N/A
- Statements: N/A
- Safety Statements: N/A
- WGK Germany:
- RTECS:
- HazardClass: N/A
- PackingGroup: N/A
- Hazardous Substances Data: 5955-78-2(Hazardous Substances Data)
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Check Digit Verification of cas no
The CAS Registry Mumber 5955-78-2 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,9,5 and 5 respectively; the second part has 2 digits, 7 and 8 respectively.Calculate Digit Verification of CAS Registry Number 5955-78:
(6*5)+(5*9)+(4*5)+(3*5)+(2*7)+(1*8)=132
132 % 10 = 2
So 5955-78-2 is a valid CAS Registry Number.
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5-methyl-2-{[(4-{[4-(4-nitrophenyl)piperazin-1-yl]carbonyl}-1,3-thiazol-2-yl)methyl]sulfanyl}-1,3-benzoxazole
