12,12-dimethyl-N-(3-methylbutyl)-5-methylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
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12,12-dimethyl-N-(3-methylbutyl)-5-methylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
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CAS No:
844832-89-9
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Formula:
C17H25N3OS2
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Chemical Name:
12,12-dimethyl-N-(3-methylbutyl)-5-methylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
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Synonyms:
ZINC2410154;STL343223;AKOS022120735;MCULE-9211078235;6,6-dimethyl-N-(3-methylbutyl)-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine;844832-89-9
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CAS No:
12,12-dimethyl-N-(3-methylbutyl)-5-methylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine Basic Attributes
351.5 g/mol
351.14390478 g/mol
Computed Properties
Molecular Weight:351.5
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:351.14390478
Monoisotopic Mass:351.14390478
Topological Polar Surface Area:101
Heavy Atom Count:23
Complexity:407
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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