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1239034-70-8

1239034-70-8 structural image
Product Name: 4-(2-Methyl-l,2^,4-tetrahydro-pyrido[4,3-6]indol-5-ylmethyl)beiizoic acid methyl ester
Formula: C21H22N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 334.4 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 334.168127949 g/mol
Monoisotopic Mass 334.168127949 g/mol
Topological Polar Surface Area 34.5 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 475
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 1
Compound Is Canonicalized Yes