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Home > Quinoline > 1354958-14-7
1354958-14-7 | 5-(5-methyl-1H-1,3-benzodiazol-2-yl)quinoline
CAS No: 1354958-14-7 Catalog No: AG019S2E MDL No:MFCD20441746
Product Description
Catalog Number:
AG019S2E
Chemical Name:
5-(5-methyl-1H-1,3-benzodiazol-2-yl)quinoline
CAS Number:
1354958-14-7
Molecular Formula:
C17H13N3
Molecular Weight:
259.3052
MDL Number:
MFCD20441746
IUPAC Name:
5-(6-methyl-1H-benzimidazol-2-yl)quinoline
InChI:
InChI=1S/C17H13N3/c1-11-7-8-15-16(10-11)20-17(19-15)13-4-2-6-14-12(13)5-3-9-18-14/h2-10H,1H3,(H,19,20)
InChI Key:
KUGCZESINVHLBV-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)nc([nH]2)c1cccc2c1cccn2
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.111g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
259.312g/mol
Monoisotopic Mass:
259.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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