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932548-07-7 | N-butyl-N-(furan-2-ylmethyl)-4,5,6,7-tetrahydrobenzo[d]isoxazole-3-carboxamide
CAS No: 932548-07-7 Catalog No: AG00H5FV MDL No:
Product Description
Catalog Number:
AG00H5FV
Chemical Name:
N-butyl-N-(furan-2-ylmethyl)-4,5,6,7-tetrahydrobenzo[d]isoxazole-3-carboxamide
CAS Number:
932548-07-7
IUPAC Name:
N-butyl-N-(furan-2-ylmethyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
InChI:
InChI=1S/C17H22N2O3/c1-2-3-10-19(12-13-7-6-11-21-13)17(20)16-14-8-4-5-9-15(14)22-18-16/h6-7,11H,2-5,8-10,12H2,1H3
InChI Key:
WPLXGUZQNUANNF-UHFFFAOYSA-N
Properties
Complexity:
377
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.163g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.374g/mol
Monoisotopic Mass:
302.163g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
59.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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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