 Home > Encyclopedia > 2-[(11-benzyl-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide

2-[(11-benzyl-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide

2-[(11-benzyl-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide structure

CAS No:
561008-13-7
Formula:
C20H18F3N3O2S2
Chemical Name:
2-[(11-benzyl-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide
Synonyms:
ZINC3334282;AKOS033680743;MCULE-6199938694;Z19406174;2-({11-benzyl-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-10-yl}sulfanyl)-N-(2,2,2-trifluoroethyl)acetamide;561008-13-7

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2-[(11-benzyl-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide Basic Attributes

Molecular Weight：

453.5 g/mol

Exact Mass：

453.07925366 g/mol

Characteristics

PSA：

115 Å²

Computed Properties

Molecular Weight:453.5
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:453.07925366
Monoisotopic Mass:453.07925366
Topological Polar Surface Area:115
Heavy Atom Count:30
Complexity:697
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(11-benzyl-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide

Basic Attributes
Characteristics
Computed Properties

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