8-(2-hydroxyethylsulfanyl)-1,3,7-trimethylpurine-2,6-dione
-
8-(2-hydroxyethylsulfanyl)-1,3,7-trimethylpurine-2,6-dione
structure -
-
CAS No:
114864-92-5
-
Formula:
C10H14N4O3S
-
Chemical Name:
8-(2-hydroxyethylsulfanyl)-1,3,7-trimethylpurine-2,6-dione
-
Synonyms:
CAFFEINE, 8-((2-HYDROXYETHYL)THIO)-;114864-92-5;BRN 0385021;8-((2-Hydroxyethyl)thio)caffeine;ACMC-20mkvj;8-(2-hydroxyethylsulfanyl)-1,3,7-trimethylpurine-2,6-dione;4-26-00-02735 (Beilstein Handbook Reference);DTXSID90150886;1H-Purine-2,6-dione,3,7-dihydro-8-[(2-hydroxyethyl)thio]-1,3,7-trimethyl-
-
CAS No:
8-(2-hydroxyethylsulfanyl)-1,3,7-trimethylpurine-2,6-dione Basic Attributes
270.31 g/mol
270.07866149 g/mol
DTXSID90150886
Computed Properties
Molecular Weight:270.31
XLogP3:0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:270.07866149
Monoisotopic Mass:270.07866149
Topological Polar Surface Area:104
Heavy Atom Count:18
Complexity:367
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Request for Quotation