8-Fluoro-2,4(1H,3H)-quinazolinedione - CAS 959236-96-5
Catalog: |
BB041886 |
Product Name: |
8-Fluoro-2,4(1H,3H)-quinazolinedione |
CAS: |
959236-96-5 |
Synonyms: |
8-fluoro-1H-quinazoline-2,4-dione; 8-fluoro-1H-quinazoline-2,4-dione |
IUPAC Name: | 8-fluoro-1H-quinazoline-2,4-dione |
Description: | 8-Fluoro-2,4(1H,3H)-quinazolinedione (CAS# 959236-96-5) is a useful research chemical. |
Molecular Weight: | 180.14 |
Molecular Formula: | C8H5FN2O2 |
Canonical SMILES: | C1=CC2=C(C(=C1)F)NC(=O)NC2=O |
InChI: | InChI=1S/C8H5FN2O2/c9-5-3-1-2-4-6(5)10-8(13)11-7(4)12/h1-3H,(H2,10,11,12,13) |
InChI Key: | FWGXKHUKBVXXCD-UHFFFAOYSA-N |
Storage: | Inert atmosphere, Room Temperature |
LogP: | 1.18010 |
Publication Number | Title | Priority Date |
EA-026729-B1 | SUBSTITUTED TETRAHYDROCARBAZOLE AND CARBAZOLKARBOXAMIDE CONNECTIONS | 20130625 |
TW-201536774-A | Substituted tetrahydrocarbazole and carbazole carbamide compounds | 20130625 |
EP-2709990-A1 | 1-(arylmethyl)quinazoline-2,4(1h,3h)-diones as parp inhibitors and the use thereof | 20110401 |
EP-2709990-B1 | 1-((3-((1-Piperazinyl)carbonyl)phenyl)methyl)-2,4(1H,3H)-quinazolinedione derivatives as PARP inhibitors for treating cancer | 20110401 |
TW-I527800-B | 1-(arylmethyl)quinazoline-2,4(1H,3H)-dione as inhibitor of poly(ADP-ribose) polymerase (PARP) and application thereof | 20110401 |
Complexity: | 257 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 180.03350557 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 180.03350557 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 58.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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Quinazolines
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