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Home > Imidazoles > 152460-59-8
152460-59-8 | 4H-Imidazo[4,5-c]pyridin-4-one, 2-butyl-3,5-dihydro-3-(phenylmethyl)-
CAS No: 152460-59-8 Catalog No: AG007YLM MDL No:
Product Description
Catalog Number:
AG007YLM
Chemical Name:
4H-Imidazo[4,5-c]pyridin-4-one, 2-butyl-3,5-dihydro-3-(phenylmethyl)-
CAS Number:
152460-59-8
Molecular Formula:
C17H19N3O
Molecular Weight:
281.3523
IUPAC Name:
3-benzyl-2-butyl-5H-imidazo[4,5-c]pyridin-4-one
InChI:
InChI=1S/C17H19N3O/c1-2-3-9-15-19-14-10-11-18-17(21)16(14)20(15)12-13-7-5-4-6-8-13/h4-8,10-11H,2-3,9,12H2,1H3,(H,18,21)
InChI Key:
FQDVKGQGBIIZDY-UHFFFAOYSA-N
SMILES:
CCCCc1nc2c(n1Cc1ccccc1)c(=O)[nH]cc2
Properties
Complexity:
390
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.153g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.359g/mol
Monoisotopic Mass:
281.153g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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