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Home > Imidazoles > 134115-99-4
134115-99-4 | Benzeneacetamide, N-[2-(1H-imidazol-4-yl)ethyl]-
CAS No: 134115-99-4 Catalog No: AG008039 MDL No:
Product Description
Catalog Number:
AG008039
Chemical Name:
Benzeneacetamide, N-[2-(1H-imidazol-4-yl)ethyl]-
CAS Number:
134115-99-4
Molecular Formula:
C13H15N3O
Molecular Weight:
229.2777
IUPAC Name:
N-[2-(1H-imidazol-5-yl)ethyl]-2-phenylacetamide
InChI:
InChI=1S/C13H15N3O/c17-13(8-11-4-2-1-3-5-11)15-7-6-12-9-14-10-16-12/h1-5,9-10H,6-8H2,(H,14,16)(H,15,17)
InChI Key:
NVQPCTZTCWXYIH-UHFFFAOYSA-N
SMILES:
O=C(Cc1ccccc1)NCCc1c[nH]cn1
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.122g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
229.283g/mol
Monoisotopic Mass:
229.122g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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