N-(2,6-dichlorophenyl)-2-[[3-(4-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide
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N-(2,6-dichlorophenyl)-2-[[3-(4-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide
structure -
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CAS No:
476485-58-2
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Formula:
C25H21Cl2N3O3S2
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Chemical Name:
N-(2,6-dichlorophenyl)-2-[[3-(4-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide
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Synonyms:
476485-58-2;N-(2,6-dichlorophenyl)-2-{[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide;ZINC2214345;STL337440;AKOS002176147;MCULE-8600293436;ST50062941;N-(2,6-Dichlorophenyl)-2-((3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamide;N-(2,6-dichlorophenyl)-2-[3-(4-methoxyphenyl)-4-oxo(3,5,6,7,8-pentahydrobenzo[ b]thiopheno[2,3-d]pyrimidin-2-ylthio)]acetamide
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CAS No:
N-(2,6-dichlorophenyl)-2-[[3-(4-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide Basic Attributes
546.5 g/mol
545.0401393 g/mol
Safety Information
|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P273, P280, P305+P351+P338, P337+P313, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:546.5
XLogP3:6.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:545.0401393
Monoisotopic Mass:545.0401393
Topological Polar Surface Area:125
Heavy Atom Count:35
Complexity:816
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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