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Home > Imidazoles > 183613-77-6
183613-77-6 | Methanone, 1H-benzimidazol-6-yl(1-methyl-1H-indol-3-yl)-
CAS No: 183613-77-6 Catalog No: AG0027QP MDL No:
Product Description
Catalog Number:
AG0027QP
Chemical Name:
Methanone, 1H-benzimidazol-6-yl(1-methyl-1H-indol-3-yl)-
CAS Number:
183613-77-6
Molecular Formula:
C17H13N3O
Molecular Weight:
275.3046
IUPAC Name:
3H-benzimidazol-5-yl-(1-methylindol-3-yl)methanone
InChI:
InChI=1S/C17H13N3O/c1-20-9-13(12-4-2-3-5-16(12)20)17(21)11-6-7-14-15(8-11)19-10-18-14/h2-10H,1H3,(H,18,19)
InChI Key:
OABFHFHDZKBBBX-UHFFFAOYSA-N
SMILES:
O=C(c1cn(c2c1cccc2)C)c1ccc2c(c1)[nH]cn2
Properties
Complexity:
413
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.106g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
275.311g/mol
Monoisotopic Mass:
275.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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