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Home > Imidazoles > 88138-11-8
88138-11-8 | Benzamide, N-[4-[[6-(1H-imidazol-1-yl)hexyl]oxy]phenyl]-4-methoxy-
CAS No: 88138-11-8 Catalog No: AG004H54 MDL No:
Product Description
Catalog Number:
AG004H54
Chemical Name:
Benzamide, N-[4-[[6-(1H-imidazol-1-yl)hexyl]oxy]phenyl]-4-methoxy-
CAS Number:
88138-11-8
Molecular Formula:
C23H27N3O3
Molecular Weight:
393.4788
IUPAC Name:
N-[4-(6-imidazol-1-ylhexoxy)phenyl]-4-methoxybenzamide
InChI:
InChI=1S/C23H27N3O3/c1-28-21-10-6-19(7-11-21)23(27)25-20-8-12-22(13-9-20)29-17-5-3-2-4-15-26-16-14-24-18-26/h6-14,16,18H,2-5,15,17H2,1H3,(H,25,27)
InChI Key:
LCLOAQFLEGYETF-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(=O)Nc1ccc(cc1)OCCCCCCn1cncc1
Properties
Complexity:
460
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
393.205g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
393.487g/mol
Monoisotopic Mass:
393.205g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
65.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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