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Also known as: 503615-03-0, 3-(4-morpholinyl)-1-(4-nitrophenyl)-5,6-dihydro-2(1h)-pyridinone, 5,6-dihydro-3-(4-morpholinyl)-1-(4-nitrophenyl)-2(1h)-pyridinone, 5-morpholin-4-yl-1-(4-nitrophenyl)-2,3-dihydropyridin-6-one, 2(1h)-pyridinone, 5,6-dihydro-3-(4-morpholinyl)-1-(4-nitrophenyl)-, Mfcd19440872
Molecular Formula
C15H17N3O4
Molecular Weight
303.31  g/mol
InChI Key
LBFAEOWNWSDWRZ-UHFFFAOYSA-N

CAS 503615-03-0
1 2D Structure

CAS 503615-03-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
5-morpholin-4-yl-1-(4-nitrophenyl)-2,3-dihydropyridin-6-one
2.1.2 InChI
InChI=1S/C15H17N3O4/c19-15-14(16-8-10-22-11-9-16)2-1-7-17(15)12-3-5-13(6-4-12)18(20)21/h2-6H,1,7-11H2
2.1.3 InChI Key
LBFAEOWNWSDWRZ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CN(C(=O)C(=C1)N2CCOCC2)C3=CC=C(C=C3)[N+](=O)[O-]
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 503615-03-0

2. 3-(4-morpholinyl)-1-(4-nitrophenyl)-5,6-dihydro-2(1h)-pyridinone

3. 5,6-dihydro-3-(4-morpholinyl)-1-(4-nitrophenyl)-2(1h)-pyridinone

4. 5-morpholin-4-yl-1-(4-nitrophenyl)-2,3-dihydropyridin-6-one

5. 2(1h)-pyridinone, 5,6-dihydro-3-(4-morpholinyl)-1-(4-nitrophenyl)-

6. Mfcd19440872

7. 3-(morpholinyl)-n-(4-nitrophenyl)-5,6-dihydropyridin-2-one

8. Schembl1995413

9. Dtxsid90620357

10. Amy31239

11. Bcp11848

12. Cs-m1442

13. Akos015951080

14. Zinc100004338

15. As-19240

16. Da-18294

17. Sy227010

18. Ft-0754958

19. A846988

20. 3-morpholino-1-(4-nitrophenyl) -5,6-dihydropyridin-2(1h)-one

21. 3-(morpholin-4-yl)-1-(4-nitrophenyl)-5,6-dihydropyridin-2(1h)-one

22. 3-morpholin-4-yl-1-(4-nitro-phenyl)-5,6-dihydro-1h-pyridin-2-one

23. 5,6-dihydro-3-(4-morpholinyl)-1-(4-nitrophenyl)-2(1h)-pyridinone;3-morpholino-1-(4-nitrophenyl)-5,6-dihydropyridin-2(1h)-one

2.3 Create Date
2007-12-05
3 Chemical and Physical Properties
Molecular Weight 303.31 g/mol
Molecular Formula C15H17N3O4
XLogP31.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass303.12190603 g/mol
Monoisotopic Mass303.12190603 g/mol
Topological Polar Surface Area78.6 Ų
Heavy Atom Count22
Formal Charge0
Complexity460
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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