12,12-dimethyl-5-prop-2-enylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
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![12,12-dimethyl-5-prop-2-enylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/4a33a3ebf0e34aa89668884a4abc3e07.png "12,12-dimethyl-5-prop-2-enylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one")
12,12-dimethyl-5-prop-2-enylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
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CAS No:
301353-61-7
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Formula:
C14H16N2O2S2
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Chemical Name:
12,12-dimethyl-5-prop-2-enylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
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Synonyms:
Cambridge id 5646960;MLS001210857;CHEMBL1866590;HMS1678P04;ZINC8742592;STK855009;STL349867;AKOS000506459;AKOS005631150;MCULE-5347243574;SMR000513538;ST50224004;AB00091562-01;2-Allylsulfanyl-6,6-dimethyl-3,5,6,8-tetrahydro-7-oxa-9-thia-1,3-diaza-fluoren-4-one;301353-61-7;6,6-dimethyl-2-(prop-2-en-1-ylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one;6,6-dimethyl-2-(prop-2-en-1-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol;6,6-dimethyl-2-prop-2-enylthio-3,5,6-trihydro-8H-pyrimidino[5',4'-4,5]thiophen o[2,3-c]pyran-4-one
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CAS No:
12,12-dimethyl-5-prop-2-enylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one Basic Attributes
308.4 g/mol
308.06532010 g/mol
Computed Properties
Molecular Weight:308.4
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:308.06532010
Monoisotopic Mass:308.06532010
Topological Polar Surface Area:104
Heavy Atom Count:20
Complexity:464
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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