Ro41-1049(hydrochloride)


Chemical Name: Ro41-1049(hydrochloride)
CAS Number: 127917-66-2
Product Number: AG009CNQ(AGN-PC-0WNHCE)
Synonyms:
MDL No:
Molecular Formula: C12H13ClFN3OS
Molecular Weight: 301.7675

Identification/Properties


Computed Properties
Molecular Weight:
301.764g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
301.045g/mol
Monoisotopic Mass:
301.045g/mol
Topological Polar Surface Area:
96.2A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
293
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
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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