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113779-02-5 | Acetamide, 2-(dimethylamino)-N-(4-methoxyphenyl)-
CAS No: 113779-02-5 Catalog No: AG0009NC MDL No:
Product Description
Catalog Number:
AG0009NC
Chemical Name:
Acetamide, 2-(dimethylamino)-N-(4-methoxyphenyl)-
CAS Number:
113779-02-5
Molecular Formula:
C11H16N2O2
Molecular Weight:
208.2569
IUPAC Name:
2-(dimethylamino)-N-(4-methoxyphenyl)acetamide
InChI:
InChI=1S/C11H16N2O2/c1-13(2)8-11(14)12-9-4-6-10(15-3)7-5-9/h4-7H,8H2,1-3H3,(H,12,14)
InChI Key:
JAHAUROSDQLZQG-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)NC(=O)CN(C)C
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.121g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.261g/mol
Monoisotopic Mass:
208.121g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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