 Home > Encyclopedia > N-(3,5-dimethylphenyl)-2-[[3-(4-ethoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide

N-(3,5-dimethylphenyl)-2-[[3-(4-ethoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide

N-(3,5-dimethylphenyl)-2-[[3-(4-ethoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide structure

CAS No:
477318-97-1
Formula:
C28H29N3O3S2
Chemical Name:
N-(3,5-dimethylphenyl)-2-[[3-(4-ethoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide
Synonyms:
477318-97-1;N-(3,5-Dimethylphenyl)-2-((3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamide;N-(3,5-dimethylphenyl)-2-{[3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide;ZINC2259255;STK699362;ZINC02259255;AKOS002177709;MCULE-4215457179;ST50063062;N-(3,5-dimethylphenyl)-2-[3-(4-ethoxyphenyl)-4-oxo(3,5,6,7,8-pentahydrobenzo[b ]thiopheno[2,3-d]pyrimidin-2-ylthio)]acetamide

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N-(3,5-dimethylphenyl)-2-[[3-(4-ethoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide Basic Attributes

Molecular Weight：

519.7 g/mol

Exact Mass：

519.16503414 g/mol

Characteristics

PSA：

125 Å²

Safety Information

GHS Classification：

|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:519.7
XLogP3:6.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:519.16503414
Monoisotopic Mass:519.16503414
Topological Polar Surface Area:125
Heavy Atom Count:36
Complexity:821
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(3,5-dimethylphenyl)-2-[[3-(4-ethoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide

Basic Attributes
Characteristics
Safety Information
Computed Properties

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