methyl 2-(2-chlorophenyl)-2-(2-oxo-4,6,7,7a-tetrahydrothieno[3,2-c]pyridin-5-yl)acetate;hydrochloride


Chemical Name: methyl 2-(2-chlorophenyl)-2-(2-oxo-4,6,7,7a-tetrahydrothieno[3,2-c]pyridin-5-yl)acetate;hydrochloride
CAS Number: 109904-27-0
Product Number: AG007W71(AGN-PC-07Y4TQ)
Synonyms:
MDL No:
Molecular Formula: C16H17Cl2NO3S
Molecular Weight: 374.2821

Identification/Properties


Computed Properties
Molecular Weight:
374.276g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
373.031g/mol
Monoisotopic Mass:
373.031g/mol
Topological Polar Surface Area:
71.9A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
496
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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