12,12-dimethyl-5-methylsulfanyl-N-(pyridin-3-ylmethyl)-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-5-methylsulfanyl-N-(pyridin-3-ylmethyl)-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:
844456-95-7
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Formula:
C18H20N4OS2
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Chemical Name:
12,12-dimethyl-5-methylsulfanyl-N-(pyridin-3-ylmethyl)-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:
ZINC2402951;STL342651;AKOS022120744;MCULE-1083703403;6,6-dimethyl-2-(methylsulfanyl)-N-(pyridin-3-ylmethyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine;844456-95-7
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CAS No:
12,12-dimethyl-5-methylsulfanyl-N-(pyridin-3-ylmethyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine Basic Attributes
372.5 g/mol
372.10785362 g/mol
Computed Properties
Molecular Weight:372.5
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:372.10785362
Monoisotopic Mass:372.10785362
Topological Polar Surface Area:114
Heavy Atom Count:25
Complexity:466
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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