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734-44-1 | 4(3H)-Quinazolinone, 7-amino-2-methyl-3-(2-methylphenyl)-
CAS No: 734-44-1 Catalog No: AG005E0E MDL No:
Product Description
Catalog Number:
AG005E0E
Chemical Name:
4(3H)-Quinazolinone, 7-amino-2-methyl-3-(2-methylphenyl)-
CAS Number:
734-44-1
Molecular Formula:
C16H15N3O
Molecular Weight:
265.3098
IUPAC Name:
7-amino-2-methyl-3-(2-methylphenyl)quinazolin-4-one
InChI:
InChI=1S/C16H15N3O/c1-10-5-3-4-6-15(10)19-11(2)18-14-9-12(17)7-8-13(14)16(19)20/h3-9H,17H2,1-2H3
InChI Key:
SWFRTLIVJQMMEV-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)nc(n(c2=O)c1ccccc1C)C
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.122g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.316g/mol
Monoisotopic Mass:
265.122g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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