3-hydroxy-2-(4-methoxyphenyl)-4-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yliminomethyl)isoquinolin-1-one
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![3-hydroxy-2-(4-methoxyphenyl)-4-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yliminomethyl)isoquinolin-1-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/105604f8b30f4244927430cd2a852b63.png "3-hydroxy-2-(4-methoxyphenyl)-4-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yliminomethyl)isoquinolin-1-one")
3-hydroxy-2-(4-methoxyphenyl)-4-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yliminomethyl)isoquinolin-1-one
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CAS No:
728939-17-1
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Formula:
C27H22N4O3S
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Chemical Name:
3-hydroxy-2-(4-methoxyphenyl)-4-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yliminomethyl)isoquinolin-1-one
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Synonyms:
Z31299954;2-(4-methoxyphenyl)-4-[({8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2,4,6-tetraen-3-yl}amino)methylidene]-1,2,3,4-tetrahydroisoquinoline-1,3-dione;728939-17-1
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CAS No:
3-hydroxy-2-(4-methoxyphenyl)-4-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yliminomethyl)isoquinolin-1-one Basic Attributes
482.6 g/mol
482.14126175 g/mol
Computed Properties
Molecular Weight:482.6
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:482.14126175
Monoisotopic Mass:482.14126175
Topological Polar Surface Area:116
Heavy Atom Count:35
Complexity:857
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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