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23058-90-4 | Benzenepropanamide, N-(3-methoxyphenyl)-β-oxo-
CAS No: 23058-90-4 Catalog No: AG002M1I MDL No:MFCD00706217
Product Description
Catalog Number:
AG002M1I
Chemical Name:
Benzenepropanamide, N-(3-methoxyphenyl)-β-oxo-
CAS Number:
23058-90-4
Molecular Formula:
C16H15NO3
Molecular Weight:
269.2952
MDL Number:
MFCD00706217
IUPAC Name:
N-(3-methoxyphenyl)-3-oxo-3-phenylpropanamide
InChI:
InChI=1S/C16H15NO3/c1-20-14-9-5-8-13(10-14)17-16(19)11-15(18)12-6-3-2-4-7-12/h2-10H,11H2,1H3,(H,17,19)
InChI Key:
OEDNBPIBTOTXHM-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)NC(=O)CC(=O)c1ccccc1
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.105g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.3g/mol
Monoisotopic Mass:
269.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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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