1-[(2-chloro-3,4-dimethoxyphenyl)methyl]-6-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole;hydrochloride


Chemical Name: 1-[(2-chloro-3,4-dimethoxyphenyl)methyl]-6-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole;hydrochloride
CAS Number: 172895-39-5
Product Number: AG00ASXP(AGN-PC-0MW8OJ)
Synonyms:
MDL No:
Molecular Formula: C21H24Cl2N2O2
Molecular Weight: 407.3335

Identification/Properties


Computed Properties
Molecular Weight:
407.335g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
406.121g/mol
Monoisotopic Mass:
406.121g/mol
Topological Polar Surface Area:
46.3A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
479
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:
2
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



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