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Home > Encyclopedia > [(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2-[4-[2-chloroethyl(methyl)amino]phenyl]-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl dihydrogen phosphate

[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2-[4-[2-chloroethyl(methyl)amino]phenyl]-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl dihydrogen phosphate

[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2-[4-[2-chloroethyl(methyl)amino]phenyl]-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl dihydrogen phosphate structure

[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2-[4-[2-chloroethyl(methyl)amino]phenyl]-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl dihydrogen phosphate 

structure
  • CAS No:

    47764-28-3

  • Formula:

    C20H24ClN6O7P

  • Chemical Name:

    [(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2-[4-[2-chloroethyl(methyl)amino]phenyl]-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl dihydrogen phosphate

  • Synonyms:

    47764-28-3;2',3'-O-((4-((2-Chloroethyl)methylamino)phenyl)methylene)-5'-adenylic acid;DTXSID30963932;5'-Adenylic acid, 2',3'-O-((4-((2-chloroethyl)methylamino)phenyl)methylene)-;9-[2,3-O-({4-[(2-Chloroethyl)(methyl)amino]phenyl}methylidene)-5-O-phosphonopentofuranosyl]-9H-purin-6-amine

[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2-[4-[2-chloroethyl(methyl)amino]phenyl]-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl dihydrogen phosphate Basic Attributes

526.9 g/mol

526.1132618 g/mol

Characteristics

167 Ų

Computed Properties

Molecular Weight:526.9
XLogP3:-0.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:8
Exact Mass:526.1132618
Monoisotopic Mass:526.1132618
Topological Polar Surface Area:167
Heavy Atom Count:35
Complexity:776
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2-[4-[2-chloroethyl(methyl)amino]phenyl]-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl dihydrogen phosphate

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