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Home > Imidazoles > 88137-94-4
88137-94-4 | Acetamide, N-[3-[[5-(1H-imidazol-1-yl)pentyl]oxy]phenyl]-
CAS No: 88137-94-4 Catalog No: AG004H58 MDL No:
Product Description
Catalog Number:
AG004H58
Chemical Name:
Acetamide, N-[3-[[5-(1H-imidazol-1-yl)pentyl]oxy]phenyl]-
CAS Number:
88137-94-4
Molecular Formula:
C16H21N3O2
Molecular Weight:
287.3568
IUPAC Name:
N-[3-(5-imidazol-1-ylpentoxy)phenyl]acetamide
InChI:
InChI=1S/C16H21N3O2/c1-14(20)18-15-6-5-7-16(12-15)21-11-4-2-3-9-19-10-8-17-13-19/h5-8,10,12-13H,2-4,9,11H2,1H3,(H,18,20)
InChI Key:
UYCHHWCQEPJZIN-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cccc(c1)OCCCCCn1cncc1
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.163g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
287.363g/mol
Monoisotopic Mass:
287.163g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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