ethyl 2-[(4-benzyl-11-ethyl-3-oxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetate
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ethyl 2-[(4-benzyl-11-ethyl-3-oxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetate
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CAS No:
369608-75-3
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Formula:
C22H25N3O3S2
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Chemical Name:
ethyl 2-[(4-benzyl-11-ethyl-3-oxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetate
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Synonyms:
ethyl [(3-benzyl-7-ethyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate;Oprea1_246054;STK033306;ZINC20813440;AKOS022081424;MCULE-3381468443;369608-75-3
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CAS No:
ethyl 2-[(4-benzyl-11-ethyl-3-oxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetate Basic Attributes
443.6 g/mol
443.13373402 g/mol
Computed Properties
Molecular Weight:443.6
XLogP3:3.9
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:443.13373402
Monoisotopic Mass:443.13373402
Topological Polar Surface Area:116
Heavy Atom Count:30
Complexity:668
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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