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101440-64-6 | 4(3H)-Quinazolinone, 3-(4-bromophenyl)-2-propyl-
CAS No: 101440-64-6 Catalog No: AG0004IF MDL No:
Product Description
Catalog Number:
AG0004IF
Chemical Name:
4(3H)-Quinazolinone, 3-(4-bromophenyl)-2-propyl-
CAS Number:
101440-64-6
Molecular Formula:
C17H15BrN2O
Molecular Weight:
343.2178
IUPAC Name:
3-(4-bromophenyl)-2-propylquinazolin-4-one
InChI:
InChI=1S/C17H15BrN2O/c1-2-5-16-19-15-7-4-3-6-14(15)17(21)20(16)13-10-8-12(18)9-11-13/h3-4,6-11H,2,5H2,1H3
InChI Key:
VEBPVOBCUPTFLJ-UHFFFAOYSA-N
SMILES:
CCCc1nc2ccccc2c(=O)n1c1ccc(cc1)Br
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.037g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
343.224g/mol
Monoisotopic Mass:
342.037g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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