CAS
99168-49-7 Purity
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99168-49-7 Purity
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2-Thiazolamine,5-(methylthio)-
CAS
99171-11-6
Catalog Number
ACM99171116
Category
Other Products
Molecular Formula
C4H6N2S2
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- Product Description
- Case Study
- Custom Reviews
- Custom Q&A
- Synthetic Use
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Specification
Synonyms
Thiazole, 2-amino-5-(methylthio)- (6CI);5-(methylthio)thiazol-2-amine;Thiazole, 2-amino-5-(methylthio);2-Thiazolamine, 5-(methylthio)-
What is the molecular formula of 2-Thiazolamine,5-(methylthio)-?
The molecular formula is C4H6N2S2.
When was 2-Thiazolamine,5-(methylthio)- created and modified?
It was created on 2005-03-26 and last modified on 2023-12-30.
What is the IUPAC Name of 2-Thiazolamine,5-(methylthio)-?
The IUPAC Name is 5-methylsulfanyl-1,3-thiazol-2-amine.
What is the Canonical SMILES of 2-Thiazolamine,5-(methylthio)-?
The Canonical SMILES is CSC1=CN=C(S1)N.
What is the CAS number of 2-Thiazolamine,5-(methylthio)-?
The CAS number is 99171-11-6.
What is the molecular weight of 2-Thiazolamine,5-(methylthio)-?
The molecular weight is 146.2 g/mol.
How many hydrogen bond acceptor counts does 2-Thiazolamine,5-(methylthio)- have?
It has 4 hydrogen bond acceptor counts.
What is the topological polar surface area of 2-Thiazolamine,5-(methylthio)-?
The topological polar surface area is 92.4 Å2.
How many formal charges does 2-Thiazolamine,5-(methylthio)- have?
It has 0 formal charges.
Is the compound canonicalized?
Yes, the compound is canonicalized.
Upstream Synthesis Route 1
- 3034-22-8
- 5188-07-8
- 99171-11-6
Reference: [1] Journal of Medicinal Chemistry, 2011, vol. 54, # 12, p. 4119 - 4132
[2] Patent: WO2015/17305, 2015, A1, . Location in patent: Page/Page column 67
Upstream Synthesis Route 2
- 61296-22-8
- 5188-07-8
- 99171-11-6
Reference: [1] Patent: US2009/36467, 2009, A1, . Location in patent: Page/Page column 66; 77
Upstream Synthesis Route 3
- 1228461-89-9
- 99171-11-6
Reference: [1] Bioorganic and Medicinal Chemistry Letters, 2010, vol. 20, # 2, p. 594 - 599
Upstream Synthesis Route 4
- 36016-97-4
- 99171-11-6
Reference: [1]Journal of Organic Chemistry,1959,vol. 24,p. 187,188, 194
Upstream Synthesis Route 5
- 96-50-4
- 624-92-0
- 99171-11-6
Reference: [1]Bioorganic and Medicinal Chemistry Letters,2004,vol. 14,p. 5521 - 5525
Downstream Synthesis Route 1
- 99171-11-6
- 594-42-3
- 62-53-3
- 69949-95-7
Reference: [1]Journal of Pharmaceutical Sciences,1979,vol. 68,p. 182 - 185
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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