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Home > Imidazoles > 824428-58-2
824428-58-2 | 1H-Benzimidazole-1-acetamide, 2-benzoyl-N,N-dibutyl-6-methoxy-
CAS No: 824428-58-2 Catalog No: AG004W03 MDL No:
Product Description
Catalog Number:
AG004W03
Chemical Name:
1H-Benzimidazole-1-acetamide, 2-benzoyl-N,N-dibutyl-6-methoxy-
CAS Number:
824428-58-2
Molecular Formula:
C25H31N3O3
Molecular Weight:
421.5319
IUPAC Name:
2-(2-benzoyl-6-methoxybenzimidazol-1-yl)-N,N-dibutylacetamide
InChI:
InChI=1S/C25H31N3O3/c1-4-6-15-27(16-7-5-2)23(29)18-28-22-17-20(31-3)13-14-21(22)26-25(28)24(30)19-11-9-8-10-12-19/h8-14,17H,4-7,15-16,18H2,1-3H3
InChI Key:
NTNAWCMSGMZTHB-UHFFFAOYSA-N
SMILES:
CCCCN(C(=O)Cn1c(nc2c1cc(OC)cc2)C(=O)c1ccccc1)CCCC
Properties
Complexity:
570
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
421.237g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
421.541g/mol
Monoisotopic Mass:
421.237g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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