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90059-38-4 | 4(3H)-Quinazolinone, 3-(3-methyl-5-isoxazolyl)-2-propyl-
CAS No: 90059-38-4 Catalog No: AG00H8SA MDL No:
Product Description
Catalog Number:
AG00H8SA
Chemical Name:
4(3H)-Quinazolinone, 3-(3-methyl-5-isoxazolyl)-2-propyl-
CAS Number:
90059-38-4
Molecular Formula:
C15H15N3O2
Molecular Weight:
269.2985
IUPAC Name:
3-(3-methyl-1,2-oxazol-5-yl)-2-propylquinazolin-4-one
InChI:
InChI=1S/C15H15N3O2/c1-3-6-13-16-12-8-5-4-7-11(12)15(19)18(13)14-9-10(2)17-20-14/h4-5,7-9H,3,6H2,1-2H3
InChI Key:
BOXJSQPMROCBAS-UHFFFAOYSA-N
SMILES:
CCCc1nc2ccccc2c(=O)n1c1onc(c1)C
Properties
Complexity:
410
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.116g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.304g/mol
Monoisotopic Mass:
269.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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