2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one
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![2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/91a9e849ccdd4bea84ac0c5d3c71b0e4.png "2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one")
2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one
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CAS No:
733792-21-7
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Formula:
C17H12F3N5OS2
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Chemical Name:
2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one
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Synonyms:
ZINC3358242;AKOS033933428;MCULE-9919627967;Z25111999;2-({[4-methyl-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5-phenyl-3H,4H-thieno[2,3-d]pyrimidin-4-one;733792-21-7
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CAS No:
2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Basic Attributes
423.4 g/mol
423.04353686 g/mol
Computed Properties
Molecular Weight:423.4
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:423.04353686
Monoisotopic Mass:423.04353686
Topological Polar Surface Area:126
Heavy Atom Count:28
Complexity:628
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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