6-Bromo-2-chloroquinazolin-4(1H)-one - CAS 167158-70-5
Catalog: |
BB012362 |
Product Name: |
6-Bromo-2-chloroquinazolin-4(1H)-one |
CAS: |
167158-70-5 |
Synonyms: |
6-bromo-2-chloro-3H-quinazolin-4-one; 6-bromo-2-chloro-3H-quinazolin-4-one |
IUPAC Name: | 6-bromo-2-chloro-3H-quinazolin-4-one |
Description: | 6-Bromo-2-chloroquinazolin-4(1H)-one (CAS# 167158-70-5) is a useful research chemical. |
Molecular Weight: | 259.49 |
Molecular Formula: | C8H4BrClN2O |
Canonical SMILES: | C1=CC2=C(C=C1Br)C(=O)NC(=N2)Cl |
InChI: | InChI=1S/C8H4BrClN2O/c9-4-1-2-6-5(3-4)7(13)12-8(10)11-6/h1-3H,(H,11,12,13) |
InChI Key: | WZVAPPYRAGWFKW-UHFFFAOYSA-N |
Boiling Point: | 393.2 °C at 760 mmHg |
Density: | 1.95 g/cm3 |
LogP: | 2.33900 |
Publication Number | Title | Priority Date |
CN-113149977-A | Synthesis and application of respiratory syncytial virus inhibitor | 20200122 |
WO-2021147947-A1 | Synthesis and use of class of respiratory syncytial virus inhibitors | 20200122 |
WO-2012087938-A1 | Quinazolinone derivatives as antiviral agents | 20101220 |
CA-2518465-A1 | Dipeptidyl peptidase inhibitors | 20030325 |
CN-1894234-A | Dipeptidyl peptidase inhibitors | 20030325 |
Complexity: | 269 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 257.91955 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 257.91955 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 41.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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