6-Bromoquinazolin-2(1H)-one - CAS 79885-37-3
Catalog: |
BB036421 |
Product Name: |
6-Bromoquinazolin-2(1H)-one |
CAS: |
79885-37-3 |
Synonyms: |
6-bromo-1H-quinazolin-2-one; 6-bromo-1H-quinazolin-2-one |
IUPAC Name: | 6-bromo-1H-quinazolin-2-one |
Description: | 6-Bromoquinazolin-2(1H)-one (CAS# 79885-37-3) is a useful research chemical. |
Molecular Weight: | 225.04 |
Molecular Formula: | C8H5BrN2O |
Canonical SMILES: | C1=CC2=C(C=C1Br)C=NC(=O)N2 |
InChI: | InChI=1S/C8H5BrN2O/c9-6-1-2-7-5(3-6)4-10-8(12)11-7/h1-4H,(H,10,11,12) |
InChI Key: | HNUYWQSBQPNNOB-UHFFFAOYSA-N |
Density: | 1.82 g/cm3 |
Appearance: | Off-white to yellow to yellow-brown powder |
LogP: | 1.68560 |
Publication Number | Title | Priority Date |
CN-112239459-A | Fused ring pyrimidine amino compound, preparation method thereof, pharmaceutical composition and application | 20190719 |
WO-2021013084-A1 | Fused ring pyrimidine amino compound and preparation method, pharmaceutical composition, and use thereof | 20190719 |
AU-2016329513-A1 | 2-Aminoquinazoline derivatives as p70S6 kinase inhibitors | 20151002 |
CA-3000565-A1 | 2-aminoquinazoline derivatives as p70s6 kinase inhibitors | 20151002 |
EP-3356348-A1 | 2-aminoquinazoline derivatives as p70s6 kinase inhibitors | 20151002 |
Complexity: | 229 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 223.95853 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 223.95853 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 41.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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