8-{[(2-chlorophenyl)methyl]sulfanyl}-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
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8-{[(2-chlorophenyl)methyl]sulfanyl}-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
structure -
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CAS No:
326918-86-9
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Formula:
C22H21ClN4O2S
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Chemical Name:
8-{[(2-chlorophenyl)methyl]sulfanyl}-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
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Synonyms:
8-{[(2-chlorophenyl)methyl]sulfanyl}-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
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CAS No:
8-{[(2-chlorophenyl)methyl]sulfanyl}-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione Basic Attributes
440.94574
440.107
Computed Properties
Molecular Weight:440.9
XLogP3:4.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:440.1073748
Monoisotopic Mass:440.1073748
Topological Polar Surface Area:92.5
Heavy Atom Count:30
Complexity:618
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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