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Home > Imidazoles > 88172-38-7
88172-38-7 | Benzimidazo[1,2-a]quinoline-6-carbonitrile, 5,7-dihydro-7-methyl-5-oxo-
CAS No: 88172-38-7 Catalog No: AG004DT0 MDL No:
Product Description
Catalog Number:
AG004DT0
Chemical Name:
Benzimidazo[1,2-a]quinoline-6-carbonitrile, 5,7-dihydro-7-methyl-5-oxo-
CAS Number:
88172-38-7
Molecular Formula:
C17H11N3O
Molecular Weight:
273.2887
IUPAC Name:
7-methyl-5-oxobenzimidazolo[1,2-a]quinoline-6-carbonitrile
InChI:
InChI=1S/C17H11N3O/c1-19-14-8-4-5-9-15(14)20-13-7-3-2-6-11(13)16(21)12(10-18)17(19)20/h2-9H,1H3
InChI Key:
XRQNYPHNZPECFW-UHFFFAOYSA-N
SMILES:
N#Cc1c(=O)c2ccccc2n2c1n(C)c1c2cccc1
NSC Number:
691215
Properties
Complexity:
558
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.09g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.295g/mol
Monoisotopic Mass:
273.09g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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