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8-(decylsulfanyl)-7-isopentyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione

8-(decylsulfanyl)-7-isopentyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione structure

CAS No:
352443-55-1
Formula:
C21H36N4O2S
Chemical Name:
8-(decylsulfanyl)-7-isopentyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Synonyms:
8-(decylsulfanyl)-7-isopentyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione;ZINC8398509;STK529519;8-Decylsulfanyl-3-methyl-7-(3-methyl-butyl)-3,7-dihydro-purine-2,6-dione;AKOS001370913;MCULE-8911716519;UPCMLD0ENAT5837753:001;ST50232881;AB00988476-01;AG-690/11240097

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8-(decylsulfanyl)-7-isopentyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione Basic Attributes

Molecular Weight：

408.60114

Exact Mass：

408.256

Characteristics

PSA：

92.5

XLogP3：

6.4

Computed Properties

Molecular Weight:408.6
XLogP3:6.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:13
Exact Mass:408.25589758
Monoisotopic Mass:408.25589758
Topological Polar Surface Area:92.5
Heavy Atom Count:28
Complexity:503
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 8-(decylsulfanyl)-7-isopentyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione

Basic Attributes
Characteristics
Computed Properties

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