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CAS No.:
1985607-70-2
Catalog Number:
AG01DY9L
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01DY9L
CAS Number:
1985607-70-2
MDL Number:
MFCD31706266
IUPAC Name:
(3S)-11-phenylmethoxy-5-oxa-1,2,8-triazatricyclo[8.4.0.03,8]tetradeca-10,13-diene-9,12-dione
InChI:
InChI=1S/C17H17N3O4/c21-13-6-7-20-15(16(13)24-10-12-4-2-1-3-5-12)17(22)19-8-9-23-11-14(19)18-20/h1-7,14,18H,8-11H2/t14-/m1/s1
InChI Key:
HJTRSKVIYMCKJU-CQSZACIVSA-N
Properties
Complexity:
595  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
327.122g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
327.34g/mol
Monoisotopic Mass:
327.122g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties