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446292-08-6

446292-08-6 | 2-[[(5S)-2-Oxo-3-[4-(3-oxo-4-morpholinyl)phenyl]-5-oxazolidinyl]methyl]-1H-isoindole-1,3(2H)-dione

CAS No: 446292-08-6 Catalog No: AG003669 MDL No:MFCD11977665

Product Description

Catalog Number:
AG003669
Chemical Name:
2-[[(5S)-2-Oxo-3-[4-(3-oxo-4-morpholinyl)phenyl]-5-oxazolidinyl]methyl]-1H-isoindole-1,3(2H)-dione
CAS Number:
446292-08-6
Molecular Formula:
C22H19N3O6
Molecular Weight:
421.4028
MDL Number:
MFCD11977665
IUPAC Name:
2-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]isoindole-1,3-dione
InChI:
InChI=1S/C22H19N3O6/c26-19-13-30-10-9-23(19)14-5-7-15(8-6-14)24-11-16(31-22(24)29)12-25-20(27)17-3-1-2-4-18(17)21(25)28/h1-8,16H,9-13H2/t16-/m1/s1
InChI Key:
KUQNYAUTIWQAKY-MRXNPFEDSA-N
SMILES:
O=C1O[C@H](CN1c1ccc(cc1)N1CCOCC1=O)CN1C(=O)c2c(C1=O)cccc2
EC Number:
610-201-0

Properties

Complexity:
740  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
421.127g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
421.409g/mol
Monoisotopic Mass:
421.127g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
96.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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