4,6-Difluoroisatin - CAS 126674-93-9
Catalog: |
BB006628 |
Product Name: |
4,6-Difluoroisatin |
CAS: |
126674-93-9 |
Synonyms: |
4,6-difluoro-1H-indole-2,3-dione; 4,6-difluoro-1H-indole-2,3-dione |
IUPAC Name: | 4,6-difluoro-1H-indole-2,3-dione |
Description: | 4,6-Difluoroisatin (CAS# 126674-93-9) is a useful research chemical. |
Molecular Weight: | 183.11 |
Molecular Formula: | C8H3F2NO2 |
Canonical SMILES: | C1=C(C=C2C(=C1F)C(=O)C(=O)N2)F |
InChI: | InChI=1S/C8H3F2NO2/c9-3-1-4(10)6-5(2-3)11-8(13)7(6)12/h1-2H,(H,11,12,13) |
InChI Key: | YIVXDNUTNIKQMY-UHFFFAOYSA-N |
Density: | 1.578 g/cm3 |
MDL: | MFCD03618552 |
LogP: | 1.23760 |
Publication Number | Title | Priority Date |
WO-2021037219-A1 | Pyrazole derivative for fgfr inhibitor and preparation method therefor | 20190831 |
WO-2020257416-A1 | Targeted protein degradation of parp14 for use in therapy | 20190619 |
US-10562891-B2 | Quinazolinones as PARP14 inhibitors | 20171221 |
US-2019194174-A1 | Quinazolinones as parp14 inhibitors | 20171221 |
WO-2019126443-A1 | Quinazolinones as parp14 inhibitors | 20171221 |
Complexity: | 269 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 183.01318466 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 183.01318466 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 46.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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Indolines
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