2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
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![2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f70b7fe1844e482db549ec1ddb8ea74e.png "2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one")
2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
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CAS No:
730986-63-7
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Formula:
C21H24N4O2S
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Chemical Name:
2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
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Synonyms:
ZINC89814103;AKOS034352977;MCULE-5749439709;Z44516334;5-{[4-(2-hydroxyphenyl)piperazin-1-yl]methyl}-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one;730986-63-7
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CAS No:
2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Basic Attributes
396.5 g/mol
396.16199719 g/mol
Computed Properties
Molecular Weight:396.5
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:396.16199719
Monoisotopic Mass:396.16199719
Topological Polar Surface Area:96.4
Heavy Atom Count:28
Complexity:622
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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