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86683-57-0 | 4-Morpholinepropanamide, alpha-methyl-N-(3-phenyl-5-isoxazolyl)-
CAS No: 86683-57-0 Catalog No: AG008F9R MDL No:
Product Description
Catalog Number:
AG008F9R
Chemical Name:
4-Morpholinepropanamide, alpha-methyl-N-(3-phenyl-5-isoxazolyl)-
CAS Number:
86683-57-0
Molecular Formula:
C17H21N3O3
Molecular Weight:
315.3669
IUPAC Name:
2-methyl-3-morpholin-4-yl-N-(3-phenyl-1,2-oxazol-5-yl)propanamide
InChI:
InChI=1S/C17H21N3O3/c1-13(12-20-7-9-22-10-8-20)17(21)18-16-11-15(19-23-16)14-5-3-2-4-6-14/h2-6,11,13H,7-10,12H2,1H3,(H,18,21)
InChI Key:
ZTKNDRDEXTUPOU-UHFFFAOYSA-N
SMILES:
CC(C(=O)Nc1onc(c1)c1ccccc1)CN1CCOCC1
Properties
Complexity:
381
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.158g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
315.373g/mol
Monoisotopic Mass:
315.158g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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