pentyl 2-[[4-(4-methylphenyl)-3-oxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate
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pentyl 2-[[4-(4-methylphenyl)-3-oxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate
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CAS No:
351161-77-8
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Formula:
C25H30N2O3S2
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Chemical Name:
pentyl 2-[[4-(4-methylphenyl)-3-oxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate
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Synonyms:
pentyl {[3-(4-methylphenyl)-4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate;ZINC2271302;STK831021;AKOS001631925;MCULE-5415298366;AJ-292/15367058;SR-01000454611;SR-01000454611-1;351161-77-8;pentyl {[3-(4-methylphenyl)-4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl]thio}acetate
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CAS No:
pentyl 2-[[4-(4-methylphenyl)-3-oxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate Basic Attributes
470.7 g/mol
470.16978517 g/mol
Computed Properties
Molecular Weight:470.7
XLogP3:7.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:470.16978517
Monoisotopic Mass:470.16978517
Topological Polar Surface Area:113
Heavy Atom Count:32
Complexity:693
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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