5-[(3-fluorophenyl)methylsulfanyl]-12,12-dimethyl-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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5-[(3-fluorophenyl)methylsulfanyl]-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
structure -
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CAS No:
799827-13-7
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Formula:
C18H18FN3OS2
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Chemical Name:
5-[(3-fluorophenyl)methylsulfanyl]-12,12-dimethyl-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:
ZINC2240370;STK551804;AKOS005478769;MCULE-2927887184;2-[(3-fluorobenzyl)sulfanyl]-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine;799827-13-7
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CAS No:
5-[(3-fluorophenyl)methylsulfanyl]-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine Basic Attributes
375.5 g/mol
375.08753272 g/mol
Computed Properties
Molecular Weight:375.5
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:375.08753272
Monoisotopic Mass:375.08753272
Topological Polar Surface Area:115
Heavy Atom Count:25
Complexity:483
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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