Home Halogens 6-bromo-8-methoxy-3,4-dihydroquinazolin-4-one

6-bromo-8-methoxy-3,4-dihydroquinazolin-4-one

CAS No.:
1616828-53-5
Catalog Number:
AG01DVS1
Molecular Formula:
C9H7BrN2O2
Molecular Weight:
255.0681
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Product Description
Catalog Number:
AG01DVS1
Chemical Name:
6-bromo-8-methoxy-3,4-dihydroquinazolin-4-one
CAS Number:
1616828-53-5
Molecular Formula:
C9H7BrN2O2
Molecular Weight:
255.0681
MDL Number:
MFCD28658368
IUPAC Name:
6-bromo-8-methoxy-3H-quinazolin-4-one
InChI:
InChI=1S/C9H7BrN2O2/c1-14-7-3-5(10)2-6-8(7)11-4-12-9(6)13/h2-4H,1H3,(H,11,12,13)
InChI Key:
IVHVBVMREUQUCX-UHFFFAOYSA-N
SMILES:
COc1cc(Br)cc2c1nc[nH]c2=O
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.969g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
255.071g/mol
Monoisotopic Mass:
253.969g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties