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88137-90-0 | Acetamide, N-[4-[3-(1H-imidazol-1-yl)propoxy]phenyl]-
CAS No: 88137-90-0 Catalog No: AG004H59 MDL No:
Product Description
Catalog Number:
AG004H59
Chemical Name:
Acetamide, N-[4-[3-(1H-imidazol-1-yl)propoxy]phenyl]-
CAS Number:
88137-90-0
Molecular Formula:
C14H17N3O2
Molecular Weight:
259.3037
IUPAC Name:
N-[4-(3-imidazol-1-ylpropoxy)phenyl]acetamide
InChI:
InChI=1S/C14H17N3O2/c1-12(18)16-13-3-5-14(6-4-13)19-10-2-8-17-9-7-15-11-17/h3-7,9,11H,2,8,10H2,1H3,(H,16,18)
InChI Key:
KDOAJGCLJIKAAG-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cc1)OCCCn1cncc1
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.132g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
259.309g/mol
Monoisotopic Mass:
259.132g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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