2-[[5-(1H-indol-3-yl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one
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![2-[[5-(1H-indol-3-yl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/e18cbb8120894d59b39f34e955e2a960.png "2-[[5-(1H-indol-3-yl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one")
2-[[5-(1H-indol-3-yl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one
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CAS No:
756843-27-3
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Formula:
C26H22N6OS2
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Chemical Name:
2-[[5-(1H-indol-3-yl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one
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Synonyms:
ZINC2663551;AKOS000873769;MCULE-7770702540;Z19584436;2-({[5-(1H-indol-3-yl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5,6-dimethyl-3H,4H-thieno[2,3-d]pyrimidin-4-one;756843-27-3
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CAS No:
2-[[5-(1H-indol-3-yl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Basic Attributes
498.6 g/mol
498.12965169 g/mol
Computed Properties
Molecular Weight:498.6
XLogP3:5.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:498.12965169
Monoisotopic Mass:498.12965169
Topological Polar Surface Area:142
Heavy Atom Count:35
Complexity:828
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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