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845806-20-4

845806-20-4 structural image
Product Name: ethyl 4-(2-(4-(tert-butyl)phenyl)-1-(3-(dimethylamino)propyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrole-3-carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Formula: C29H39N3O5
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COMPUTED DESCRIPTORS

Molecular Weight 509.6 g/mol
XLogP3 5.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 10
Exact Mass 509.28897135 g/mol
Monoisotopic Mass 509.28897135 g/mol
Topological Polar Surface Area 103 Ų
Heavy Atom Count 37
Formal Charge 0
Complexity 885
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes