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124429-25-0 | Quinazoline, 6-bromo-4-ethoxy-
CAS No: 124429-25-0 Catalog No: AG000LZP MDL No:MFCD02333242
Product Description
Catalog Number:
AG000LZP
Chemical Name:
Quinazoline, 6-bromo-4-ethoxy-
CAS Number:
124429-25-0
Molecular Formula:
C10H9BrN2O
Molecular Weight:
253.0953
MDL Number:
MFCD02333242
IUPAC Name:
6-bromo-4-ethoxyquinazoline
InChI:
InChI=1S/C10H9BrN2O/c1-2-14-10-8-5-7(11)3-4-9(8)12-6-13-10/h3-6H,2H2,1H3
InChI Key:
CDKCNEGDPOMQDX-UHFFFAOYSA-N
SMILES:
CCOc1ncnc2c1cc(Br)cc2
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.99g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.099g/mol
Monoisotopic Mass:
251.99g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Small molecules enhance autophagy and reduce toxicity in Huntington's disease models. | Nature chemical biology 20070601 |
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