10-[(E)-3-phenylprop-2-enyl]sulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
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![10-[(E)-3-phenylprop-2-enyl]sulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/79a18fb58c8242a486a0b7d072fb6d89.png "10-[(E)-3-phenylprop-2-enyl]sulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one")
10-[(E)-3-phenylprop-2-enyl]sulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
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CAS No:
371235-64-2
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Formula:
C18H16N2OS2
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Chemical Name:
10-[(E)-3-phenylprop-2-enyl]sulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
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Synonyms:
371235-64-2;2-(cinnamylthio)-6,7-dihydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4(5H)-one;2-((2E)-3-phenylprop-2-enylthio)-3,5,6,7-tetrahydrocyclopenta[1,2-d]pyrimidino [4,5-b]thiophen-4-one;HMS1483K15;ZINC2891769;CCG-20845;SBB083895;STL079758;AKOS001020915;IDI1_021665;ST50485620;AB00673052-01;AF-399/40878641;SR-01000499269;SR-01000499269-1;BRD-K64739009-001-01-0;F1026-0018;10-[(E)-3-phenylprop-2-enyl]sulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one;2-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
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CAS No:
10-[(E)-3-phenylprop-2-enyl]sulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one Basic Attributes
340.5 g/mol
340.07040549 g/mol
Computed Properties
Molecular Weight:340.5
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:340.07040549
Monoisotopic Mass:340.07040549
Topological Polar Surface Area:95
Heavy Atom Count:23
Complexity:513
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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