12,12-dimethyl-4-phenyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-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-4-phenyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-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/acd2e31597d34ab19b6b895a78f7174e.png "12,12-dimethyl-4-phenyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one")
12,12-dimethyl-4-phenyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-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:
799820-02-3
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Formula:
C26H24N2O2S2
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Chemical Name:
12,12-dimethyl-4-phenyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-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:
ZINC2235530;STK549154;AKOS005476840;2-(cinnamylthio)-6,6-dimethyl-3-phenyl-5,6-dihydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4(8H)-one;6,6-dimethyl-3-phenyl-2-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one;799820-02-3
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CAS No:
12,12-dimethyl-4-phenyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one Basic Attributes
460.6 g/mol
460.12792036 g/mol
Computed Properties
Molecular Weight:460.6
XLogP3:5.9
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:460.12792036
Monoisotopic Mass:460.12792036
Topological Polar Surface Area:95.4
Heavy Atom Count:32
Complexity:740
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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