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88017-05-4 | 4-Morpholinecarboxamide,N-[2-[[2-hydroxy-3-[4-[2-(2-methylpropoxy)ethoxy]phenoxy]propyl]amino]ethyl]-
CAS No: 88017-05-4 Catalog No: AG004JSS MDL No:
Product Description
Catalog Number:
AG004JSS
Chemical Name:
4-Morpholinecarboxamide,N-[2-[[2-hydroxy-3-[4-[2-(2-methylpropoxy)ethoxy]phenoxy]propyl]amino]ethyl]-
CAS Number:
88017-05-4
Molecular Formula:
C22H37N3O6
Molecular Weight:
439.5457
IUPAC Name:
N-[2-[[2-hydroxy-3-[4-[2-(2-methylpropoxy)ethoxy]phenoxy]propyl]amino]ethyl]morpholine-4-carboxamide
InChI:
InChI=1S/C22H37N3O6/c1-18(2)16-29-13-14-30-20-3-5-21(6-4-20)31-17-19(26)15-23-7-8-24-22(27)25-9-11-28-12-10-25/h3-6,18-19,23,26H,7-17H2,1-2H3,(H,24,27)
InChI Key:
SYEJZNWACSPJHS-UHFFFAOYSA-N
SMILES:
OC(COc1ccc(cc1)OCCOCC(C)C)CNCCNC(=O)N1CCOCC1
Properties
Complexity:
468
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
439.268g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
439.553g/mol
Monoisotopic Mass:
439.268g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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