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69751-37-7 | N-(Phenyl-pyridin-3-yl-methyl)-acetamide
CAS No: 69751-37-7 Catalog No: AG01FC4W MDL No:
Product Description
Catalog Number:
AG01FC4W
Chemical Name:
N-(Phenyl-pyridin-3-yl-methyl)-acetamide
CAS Number:
69751-37-7
Molecular Formula:
C14H14N2O
Molecular Weight:
226.2738
IUPAC Name:
N-[phenyl(pyridin-3-yl)methyl]acetamide
InChI:
InChI=1S/C14H14N2O/c1-11(17)16-14(12-6-3-2-4-7-12)13-8-5-9-15-10-13/h2-10,14H,1H3,(H,16,17)
InChI Key:
HABUOKHHUUMQPB-UHFFFAOYSA-N
SMILES:
CC(=O)NC(c1cccnc1)c1ccccc1
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.111g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.279g/mol
Monoisotopic Mass:
226.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| 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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