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303091-40-9 | 1(2H)-Quinolineacetamide, N-(4-ethoxyphenyl)-3,4-dihydro-
CAS No: 303091-40-9 Catalog No: AG002ZM8 MDL No:
Product Description
Catalog Number:
AG002ZM8
Chemical Name:
1(2H)-Quinolineacetamide, N-(4-ethoxyphenyl)-3,4-dihydro-
CAS Number:
303091-40-9
Molecular Formula:
C19H22N2O2
Molecular Weight:
310.3902
IUPAC Name:
2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-ethoxyphenyl)acetamide
InChI:
InChI=1S/C19H22N2O2/c1-2-23-17-11-9-16(10-12-17)20-19(22)14-21-13-5-7-15-6-3-4-8-18(15)21/h3-4,6,8-12H,2,5,7,13-14H2,1H3,(H,20,22)
InChI Key:
CKJDBHODSSPOBG-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)NC(=O)CN1CCCc2c1cccc2
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.168g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
310.397g/mol
Monoisotopic Mass:
310.168g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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