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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 3051613Generated: October 31, 2026

1H-Purine-2,6-dione, 3,7-dihydro-7-(2-((2-(3,4-dihydroxyphenyl)ethyl)amino)ethyl)-1,3-dimethyl-, hydrochloride

https://huagongshe.com/en/chemical/3051613

1H-Purine-2,6-dione, 3,7-dihydro-7-(2-((2-(3,4-dihydroxyphenyl)ethyl)amino)ethyl)-1,3-dimethyl-, hydrochloride molecular structure

Identifiers & Physical Properties

CAS No.67553-49-5
Molecular formulaC17H22ClN5O4
Average molar mass395.8 g/mol
Monoisotopic mass395.1360319 g/mol
SMILESCl.Cn1c(=O)c2c(ncn2CCNCCc2ccc(O)c(O)c2)n(C)c1=O
InChIKeyAZIYIQQYEYYCNU-UHFFFAOYSA-N
PubChem CID3051613
DTXSIDDTXSID30217886

Chemical & Physical Properties

Topological polar surface area111
Hydrogen bond donors4
Hydrogen bond acceptors6
Rotatable bonds6
Heavy atoms27
Formal charge0
Complexity533