2-[6,7-dimethoxy-2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid


Chemical Name: 2-[6,7-dimethoxy-2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid
CAS Number: 282524-92-9
Product Number: AG00BE21(AGN-PC-01A98Y)
Synonyms:
MDL No:
Molecular Formula: C18H25NO6
Molecular Weight: 351.3942

Identification/Properties


Computed Properties
Molecular Weight:
351.399g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
6
Exact Mass:
351.168g/mol
Monoisotopic Mass:
351.168g/mol
Topological Polar Surface Area:
85.3A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
488
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


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