CAS
94291-86-8 Purity
96%
94291-86-8 Purity
96%
![N,N'-(2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-diyldipropane-1,3-diyl)bis[n-(3-hydrazino-3-oxopropyl)-beta-alaninohydrazide]](https://resource.alfa-chemistry.com/structure/94291-94-8.gif)
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1H-Pyrrolo[2,3-b]pyridine,1-(phenylsulfonyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS
942919-24-6
Catalog Number
ACM942919246
Category
Other Products
Molecular Formula
C19H21BN2O4S
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Specification
Synonyms
1H-Pyrrolo[2,3-b]pyridine, 1-(phenylsulfonyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
What is the molecular formula of the compound with PubChem CID 45074546?
The molecular formula is C19H21BN2O4S.
What are some synonyms of the compound with PubChem CID 45074546?
Some synonyms include 1-(phenylsulfonyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine and 1-(benzenesulfonyl)-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine.
What is the molecular weight of the compound?
The molecular weight is 384.3 g/mol.
What is the InChIKey of the compound?
The InChIKey is IRLJTHCRQATLLB-UHFFFAOYSA-N.
How many hydrogen bond acceptors does the compound have?
The compound has 5 hydrogen bond acceptors.
What is the topological polar surface area of the compound?
The topological polar surface area is 78.8?2.
How many rotatable bonds does the compound have?
The compound has 3 rotatable bonds.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the exact mass of the compound?
The exact mass is 384.1315085 g/mol.
What is the complexity of the compound?
The complexity is 641.
Upstream Synthesis Route 1
- 889939-25-7
- 73183-34-3
- 942919-24-6
Reference: [1]Current Patent Assignee: GLAXOSMITHKLINE PLC - US2007/149561, 2007, A1
Location in patent: Page/Page column 87
Downstream Synthesis Route 1
- 13195-50-1
- 942919-24-6
- 943321-85-5
Reference: [1]Patent: WO2007/76423,2007,A2 .Location in patent: Page/Page column 88
Downstream Synthesis Route 2
- 13195-50-1
- 942919-24-6
- 943321-45-7
Reference: [1]Patent: WO2007/76423,2007,A2 .Location in patent: Page/Page column 68
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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