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89758-17-8 | 4-Morpholinebutanamide, N-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-
CAS No: 89758-17-8 Catalog No: AG0040QA MDL No:
Product Description
Catalog Number:
AG0040QA
Chemical Name:
4-Morpholinebutanamide, N-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-
CAS Number:
89758-17-8
Molecular Formula:
C17H22N4O4
Molecular Weight:
346.3810
IUPAC Name:
N-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-4-morpholin-4-ylbutanamide
InChI:
InChI=1S/C17H22N4O4/c1-23-14-6-4-13(5-7-14)16-19-20-17(25-16)18-15(22)3-2-8-21-9-11-24-12-10-21/h4-7H,2-3,8-12H2,1H3,(H,18,20,22)
InChI Key:
UPAMQAZBMBIOOC-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1nnc(o1)NC(=O)CCCN1CCOCC1
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.164g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
346.387g/mol
Monoisotopic Mass:
346.164g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
89.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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