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5726-73-8

5726-73-8 | 6-(2-methoxyphenyl)-3-(4-nitrophenyl)-7-phenyl-8-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione

CAS No: 5726-73-8 Catalog No: AG00EZNC MDL No:

Product Description

Catalog Number:
AG00EZNC
Chemical Name:
6-(2-methoxyphenyl)-3-(4-nitrophenyl)-7-phenyl-8-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione
CAS Number:
5726-73-8
IUPAC Name:
3-(2-methoxyphenyl)-5-(4-nitrophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
InChI:
InChI=1S/C24H19N3O6/c1-32-19-10-6-5-9-18(19)21-20-22(33-26(21)16-7-3-2-4-8-16)24(29)25(23(20)28)15-11-13-17(14-12-15)27(30)31/h2-14,20-22H,1H3
InChI Key:
GFEQTTSYRQKZLP-UHFFFAOYSA-N

Properties

Complexity:
758  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
445.127g/mol
Formal Charge:
0
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
445.431g/mol
Monoisotopic Mass:
445.127g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  

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