 Home > Encyclopedia > 2-[(3-oxo-4-prop-2-enyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-5-yl)sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide

2-[(3-oxo-4-prop-2-enyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-5-yl)sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide

2-[(3-oxo-4-prop-2-enyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-5-yl)sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide structure

CAS No:
561010-29-5
Formula:
C18H20F3N3O2S2
Chemical Name:
2-[(3-oxo-4-prop-2-enyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-5-yl)sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide
Synonyms:
ZINC3341307;AKOS000824439;MCULE-4029156679;AB00720197-01;Z15647001;2-{[3-oxo-4-(prop-2-en-1-yl)-8-thia-4,6-diazatricyclo[7.5.0.0^{2,7}]tetradeca-1(9),2(7),5-trien-5-yl]sulfanyl}-N-(2,2,2-trifluoroethyl)acetamide;561010-29-5

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2-[(3-oxo-4-prop-2-enyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-5-yl)sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide Basic Attributes

Molecular Weight：

431.5 g/mol

Exact Mass：

431.09490372 g/mol

Characteristics

PSA：

115 Å²

Computed Properties

Molecular Weight:431.5
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:431.09490372
Monoisotopic Mass:431.09490372
Topological Polar Surface Area:115
Heavy Atom Count:28
Complexity:657
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(3-oxo-4-prop-2-enyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-5-yl)sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide

Basic Attributes
Characteristics
Computed Properties

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