| CAS Number | 926273-65-6 |
| Catalog Number | AG019UG4 |
| Chemical Name | Ethyl 6-bromo-4-oxo-3,4-dihydroquinazoline-2-carboxylate |
| IUPAC Name | ethyl 6-bromo-4-oxo-3H-quinazoline-2-carboxylate |
| InChI | InChI=1S/C11H9BrN2O3/c1-2-17-11(16)9-13-8-4-3-6(12)5-7(8)10(15)14-9/h3-5H,2H2,1H3,(H,13,14,15) |
| InChI Key | FBXFISPUBFVIJK-UHFFFAOYSA-N |
| MDL Number | MFCD09042597 |
| Molecular Formula | C11H9BrN2O3 |
| Molecular Weight | 297.1048 |
| SMILES | CCOC(=O)C1=NC(=O)C2=C(N1)C=CC(=C2)Br |
| Synonyms | ethyl 6-bromo-4-oxo-3,4-dihydroquinazoline-2-carboxylate,
926273-65-6,
AC1Q34DQ,
SCHEMBL8197895,
SCHEMBL18895359,
CTK6F7525,
CTK8F9629,
ZINC21953437,
AKOS000126809,
MCULE-7591384720,
NE30489,
EN300-41558,
AB01002775-01,
Z425449848,
|
| Complexity | 370 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 295.98g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 297.108g/mol |
| Monoisotopic Mass | 295.98g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 67.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number