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288392-17-6 | 3-(1-methyl-1H-imidazole-5-carbonyl)quinoline
CAS No: 288392-17-6 Catalog No: AG01BBZO MDL No:MFCD25280716
Product Description
Catalog Number:
AG01BBZO
Chemical Name:
3-(1-methyl-1H-imidazole-5-carbonyl)quinoline
CAS Number:
288392-17-6
Molecular Formula:
C14H11N3O
Molecular Weight:
237.2566
MDL Number:
MFCD25280716
IUPAC Name:
(3-methylimidazol-4-yl)-quinolin-3-ylmethanone
InChI:
InChI=1S/C14H11N3O/c1-17-9-15-8-13(17)14(18)11-6-10-4-2-3-5-12(10)16-7-11/h2-9H,1H3
InChI Key:
DEWICHSPQPNELH-UHFFFAOYSA-N
SMILES:
Cn1cncc1C(=O)c1cnc2c(c1)cccc2
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.09g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.262g/mol
Monoisotopic Mass:
237.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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