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Home > Encyclopedia > [(9R,10S,13S,14R,16S,18R)-14-(2-chloroacetyl)oxy-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-trien-18-yl] 2-chloroacetate

[(9R,10S,13S,14R,16S,18R)-14-(2-chloroacetyl)oxy-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-trien-18-yl] 2-chloroacetate

[(9R,10S,13S,14R,16S,18R)-14-(2-chloroacetyl)oxy-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-trien-18-yl] 2-chloroacetate structure

[(9R,10S,13S,14R,16S,18R)-14-(2-chloroacetyl)oxy-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-trien-18-yl] 2-chloroacetate 

structure
  • CAS No:

    2800-66-0

  • Formula:

    C24H28Cl2N2O4

  • Chemical Name:

    [(9R,10S,13S,14R,16S,18R)-14-(2-chloroacetyl)oxy-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-trien-18-yl] 2-chloroacetate

  • Synonyms:

    dichloroacetylajmaline;Dichloroacetylajmaline;2800-66-0;Ajmalan-17,21-diol, bis(chloroacetate) (ester), (17R,21alpha)-

[(9R,10S,13S,14R,16S,18R)-14-(2-chloroacetyl)oxy-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-trien-18-yl] 2-chloroacetate Basic Attributes

479.4 g/mol

478.1426128 g/mol

Characteristics

59.1 Ų

Drug Information

dichloroacetylajmaline

Computed Properties

Molecular Weight:479.4
XLogP3:4.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:478.1426128
Monoisotopic Mass:478.1426128
Topological Polar Surface Area:59.1
Heavy Atom Count:32
Complexity:813
Defined Atom Stereocenter Count:6
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [(9R,10S,13S,14R,16S,18R)-14-(2-chloroacetyl)oxy-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-trien-18-yl] 2-chloroacetate

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