2-[(12-oxo-11-propyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide
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2-[(12-oxo-11-propyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide
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CAS No:
744228-84-0
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Formula:
C21H20F3N3O2S2
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Chemical Name:
2-[(12-oxo-11-propyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide
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Synonyms:
ZINC2633820;AKOS033735150;MCULE-2505791308;AB00723513-01;Z20179007;2-({12-oxo-11-propyl-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-10-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide;744228-84-0
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CAS No:
2-[(12-oxo-11-propyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide Basic Attributes
467.5 g/mol
467.09490372 g/mol
Computed Properties
Molecular Weight:467.5
XLogP3:5.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:467.09490372
Monoisotopic Mass:467.09490372
Topological Polar Surface Area:115
Heavy Atom Count:31
Complexity:733
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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