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828273-80-9 | 4(3H)-Quinazolinone, 2-ethoxy-3-(4-methylphenyl)-
CAS No: 828273-80-9 Catalog No: AG004WYG MDL No:
Product Description
Catalog Number:
AG004WYG
Chemical Name:
4(3H)-Quinazolinone, 2-ethoxy-3-(4-methylphenyl)-
CAS Number:
828273-80-9
Molecular Formula:
C17H16N2O2
Molecular Weight:
280.3211
IUPAC Name:
2-ethoxy-3-(4-methylphenyl)quinazolin-4-one
InChI:
InChI=1S/C17H16N2O2/c1-3-21-17-18-15-7-5-4-6-14(15)16(20)19(17)13-10-8-12(2)9-11-13/h4-11H,3H2,1-2H3
InChI Key:
ZOAGDXOBZIKXDE-UHFFFAOYSA-N
SMILES:
CCOc1nc2ccccc2c(=O)n1c1ccc(cc1)C
Properties
Complexity:
413
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.121g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.327g/mol
Monoisotopic Mass:
280.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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