Cas no 876343-79-2 (1-benzenesulfonyl-5-bromo-4-chloro-2-iodo-1H-pyrrolo[2,3-b]pyridine)
![1-benzenesulfonyl-5-bromo-4-chloro-2-iodo-1H-pyrrolo[2,3-b]pyridine structure](https://ossimg.kuujia.com/scimg/876500/876343-79-2x500.png)
876343-79-2 structure
Product Name:1-benzenesulfonyl-5-bromo-4-chloro-2-iodo-1H-pyrrolo[2,3-b]pyridine
CAS No:876343-79-2
MF:C13H7BrClIN2O2S
MW:497.533352136612
CID:2133532
PubChem ID:59854553
Update Time:2025-04-21
1-benzenesulfonyl-5-bromo-4-chloro-2-iodo-1H-pyrrolo[2,3-b]pyridine Chemical and Physical Properties
Names and Identifiers
-
- 1-benzenesulfonyl-5-bromo-4-chloro-2-iodo-1H-pyrrolo[2,3-b]pyridine
- SCHEMBL5002087
- 5-Bromo-4-chloro-2-iodo-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine
- 876343-79-2
- YNXBJFOZGYCSHU-UHFFFAOYSA-N
- DB-077055
-
- Inchi： 1S/C13H7BrClIN2O2S/c14-10-7-17-13-9(12(10)15)6-11(16)18(13)21(19,20)8-4-2-1-3-5-8/h1-7H
- InChI Key： YNXBJFOZGYCSHU-UHFFFAOYSA-N
- SMILES： IC1=CC2=C(C(=CN=C2N1S(C1C=CC=CC=1)(=O)=O)Br)Cl
Computed Properties
- Exact Mass: 495.81449Da
- Monoisotopic Mass: 495.81449Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 2
- Complexity: 483
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.5
- Topological Polar Surface Area: 60.3?2
1-benzenesulfonyl-5-bromo-4-chloro-2-iodo-1H-pyrrolo[2,3-b]pyridine Related Literature
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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