5-Bromo-1-[2-(methylsulfonyl)ethyl]pyridin-2(1H)-one - CAS 1083168-88-0
Catalog: |
BB002243 |
Product Name: |
5-Bromo-1-[2-(methylsulfonyl)ethyl]pyridin-2(1H)-one |
CAS: |
1083168-88-0 |
Synonyms: |
5-bromo-1-(2-methylsulfonylethyl)-2-pyridinone; 5-bromo-1-(2-methylsulfonylethyl)pyridin-2-one |
IUPAC Name: | 5-bromo-1-(2-methylsulfonylethyl)pyridin-2-one |
Description: | 5-Bromo-1-[2-(methylsulfonyl)ethyl]pyridin-2(1H)-one (CAS# 1083168-88-0) is a useful research chemical. |
Molecular Weight: | 280.14 |
Molecular Formula: | C8H10BrNO3S |
Canonical SMILES: | CS(=O)(=O)CCN1C=C(C=CC1=O)Br |
InChI: | InChI=1S/C8H10BrNO3S/c1-14(12,13)5-4-10-6-7(9)2-3-8(10)11/h2-3,6H,4-5H2,1H3 |
InChI Key: | AGNQYMOWIBRFNN-UHFFFAOYSA-N |
LogP: | 1.73620 |
Publication Number | Title | Priority Date |
CN-111936499-A | Heterobicyclic inhibitors of MAT2A and methods for treating cancer | 20180330 |
BR-112020020104-A2 | heterobyclic inhibitors of mat2a and methods of use for the treatment of cancer | 20180330 |
US-2021115045-A1 | Heterobicyclic inhibitors of mat2a and methods of use for treating cancer | 20180330 |
JP-2021519783-A | Complex bicyclic inhibitors of MAT2A and how to use them for the treatment of cancer | 20180330 |
AU-2008251504-A1 | Modulators of CFTR | 20070509 |
Complexity: | 391 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 278.95648 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 278.95648 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 62.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.2 |
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