7-[3-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]propyl]-1,3-dimethyl-8-morpholin-4-ylpurine-2,6-dione
-
![7-[3-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]propyl]-1,3-dimethyl-8-morpholin-4-ylpurine-2,6-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f284ebced2e345f294a0748969723864.png "7-[3-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]propyl]-1,3-dimethyl-8-morpholin-4-ylpurine-2,6-dione")
7-[3-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]propyl]-1,3-dimethyl-8-morpholin-4-ylpurine-2,6-dione
structure -
-
CAS No:
62402-01-1
-
Formula:
C22H30N6O6
-
Chemical Name:
7-[3-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]propyl]-1,3-dimethyl-8-morpholin-4-ylpurine-2,6-dione
-
Synonyms:
62402-01-1;D 2928;BRN 1235007;7-(3-((2-(3,4-Dihydroxyphenyl)-2-hydroxyethyl)amino)propyl)-8-morpholinotheophylline;Theophylline, 7-(3-((2-(3,4-dihydroxyphenyl)-2-hydroxyethyl)amino)propyl)-8-morpholino-;CHEMBL1980885;DTXSID90977979;NSC293895;NSC-293895;7-[3-[[2-(3,4-Dihydroxyphenyl)-2-hydroxyethyl]amino]propyl]-8-morpholinotheophyline;7-(3-{[2-(3,4-Dihydroxyphenyl)-2-hydroxyethyl]amino}propyl)-1,3-dimethyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
-
CAS No:
7-[3-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]propyl]-1,3-dimethyl-8-morpholin-4-ylpurine-2,6-dione Basic Attributes
474.5 g/mol
474.22268270 g/mol
293895
Computed Properties
Molecular Weight:474.5
XLogP3:-0.4
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:8
Exact Mass:474.22268270
Monoisotopic Mass:474.22268270
Topological Polar Surface Area:144
Heavy Atom Count:34
Complexity:724
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Request for Quotation