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94704-28-6 | 2(3H)-Benzoxazolone, 3-methyl-5-(3-methylimidazo[1,2-a]pyridin-2-yl)-
CAS No: 94704-28-6 Catalog No: AG006T70 MDL No:
Product Description
Catalog Number:
AG006T70
Chemical Name:
2(3H)-Benzoxazolone, 3-methyl-5-(3-methylimidazo[1,2-a]pyridin-2-yl)-
CAS Number:
94704-28-6
Molecular Formula:
C16H13N3O2
Molecular Weight:
279.2933
IUPAC Name:
3-methyl-5-(3-methylimidazo[1,2-a]pyridin-2-yl)-1,3-benzoxazol-2-one
InChI:
InChI=1S/C16H13N3O2/c1-10-15(17-14-5-3-4-8-19(10)14)11-6-7-13-12(9-11)18(2)16(20)21-13/h3-9H,1-2H3
InChI Key:
XUCKWFWSASVBHE-UHFFFAOYSA-N
SMILES:
Cc1c(nc2n1cccc2)c1ccc2c(c1)n(C)c(=O)o2
Properties
Complexity:
430
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.101g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.299g/mol
Monoisotopic Mass:
279.101g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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