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76145-72-7 | 3H-Naphth[1,2-d]imidazole, 2-(2-methoxyphenyl)-3-methyl-
CAS No: 76145-72-7 Catalog No: AG008OGD MDL No:
Product Description
Catalog Number:
AG008OGD
Chemical Name:
3H-Naphth[1,2-d]imidazole, 2-(2-methoxyphenyl)-3-methyl-
CAS Number:
76145-72-7
Molecular Formula:
C19H16N2O
Molecular Weight:
288.3431
IUPAC Name:
2-(2-methoxyphenyl)-3-methylbenzo[e]benzimidazole
InChI:
InChI=1S/C19H16N2O/c1-21-16-12-11-13-7-3-4-8-14(13)18(16)20-19(21)15-9-5-6-10-17(15)22-2/h3-12H,1-2H3
InChI Key:
JASHXSVYKXHYNJ-UHFFFAOYSA-N
SMILES:
COc1ccccc1c1nc2c(n1C)ccc1c2cccc1
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.126g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.35g/mol
Monoisotopic Mass:
288.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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