 Home > Encyclopedia > N-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetamide

N-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetamide

N-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetamide structure

CAS No:
726166-06-9
Formula:
C17H12ClF3N4OS2
Chemical Name:
N-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetamide
Synonyms:
ZINC3270279;AKOS033737253;MCULE-8513425498;NCGC00281788-01;AB01282494-01;Z20228880;726166-06-9;N-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-{7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(12),2(6),8,10-tetraen-12-ylsulfanyl}acetamide

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N-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetamide Basic Attributes

Molecular Weight：

444.9 g/mol

Exact Mass：

444.0093155 g/mol

Characteristics

PSA：

121 Å²

Computed Properties

Molecular Weight:444.9
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:444.0093155
Monoisotopic Mass:444.0093155
Topological Polar Surface Area:121
Heavy Atom Count:28
Complexity:587
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetamide

Basic Attributes
Characteristics
Computed Properties

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