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1414932-73-2 | 3-Morpholinone, 4-[4-[(5S)-2-oxo-5-[[(phenylmethylene)amino]methyl]-3-oxazolidinyl]phenyl]-
CAS No: 1414932-73-2 Catalog No: AG001GHI MDL No:
Product Description
Catalog Number:
AG001GHI
Chemical Name:
3-Morpholinone, 4-[4-[(5S)-2-oxo-5-[[(phenylmethylene)amino]methyl]-3-oxazolidinyl]phenyl]-
CAS Number:
1414932-73-2
Molecular Formula:
C21H21N3O4
Molecular Weight:
379.4091
IUPAC Name:
4-[4-[(5S)-5-[(benzylideneamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]morpholin-3-one
InChI:
InChI=1S/C21H21N3O4/c25-20-15-27-11-10-23(20)17-6-8-18(9-7-17)24-14-19(28-21(24)26)13-22-12-16-4-2-1-3-5-16/h1-9,12,19H,10-11,13-15H2/t19-/m0/s1
InChI Key:
QSZGECHPLBVBPE-IBGZPJMESA-N
SMILES:
O=C1O[C@H](CN1c1ccc(cc1)N1CCOCC1=O)CN=Cc1ccccc1
Properties
Complexity:
582
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
379.153g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
379.416g/mol
Monoisotopic Mass:
379.153g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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