5-(2-chlorophenyl)-2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one
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![5-(2-chlorophenyl)-2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/90053c946e5b4b118d94e857af885fe8.png "5-(2-chlorophenyl)-2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one")
5-(2-chlorophenyl)-2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one
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CAS No:
781624-68-8
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Formula:
C17H11ClF3N5OS2
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Chemical Name:
5-(2-chlorophenyl)-2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one
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Synonyms:
ZINC3355604;AKOS000906261;MCULE-2810676451;Z25112476;5-(2-chlorophenyl)-2-({[4-methyl-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3H,4H-thieno[2,3-d]pyrimidin-4-one;781624-68-8
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CAS No:
5-(2-chlorophenyl)-2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Basic Attributes
457.9 g/mol
457.0045645 g/mol
Computed Properties
Molecular Weight:457.9
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:457.0045645
Monoisotopic Mass:457.0045645
Topological Polar Surface Area:126
Heavy Atom Count:29
Complexity:670
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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