2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-5-(4-chlorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one
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![2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-5-(4-chlorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/82c38bec71154bfda7c85b7093a80fb1.png "2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-5-(4-chlorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one")
2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-5-(4-chlorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one
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CAS No:
732987-85-8
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Formula:
C25H23ClN4O3S
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Chemical Name:
2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-5-(4-chlorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one
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Synonyms:
ZINC21540892;AKOS001000551;MCULE-9134046938;Z44518284;2-({4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}methyl)-5-(4-chlorophenyl)-3H,4H-thieno[2,3-d]pyrimidin-4-one;732987-85-8
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CAS No:
2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-5-(4-chlorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one Basic Attributes
495.0 g/mol
494.1179395 g/mol
Computed Properties
Molecular Weight:495.0
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:494.1179395
Monoisotopic Mass:494.1179395
Topological Polar Surface Area:94.6
Heavy Atom Count:34
Complexity:771
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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