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

N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide

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

CAS No:
618427-88-6
Formula:
C21H19ClF3N3O2S2
Chemical Name:
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Synonyms:
618427-88-6;N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(3-ethyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide;ZINC2415413;STL354818;AKOS002188352;MCULE-9554161478;ST50081360;N-(2-Chloro-5-(trifluoromethyl)phenyl)-2-((3-ethyl-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamide;N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(3-ethyl-4-oxo(3,5,6,7,8-pentahydrobe nzo[b]thiopheno[2,3-d]pyrimidin-2-ylthio))acetamide

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

Molecular Weight：

502.0 g/mol

Exact Mass：

501.0559314 g/mol

Characteristics

PSA：

115 Å²

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P273, P280, P301+P312, P305+P351+P338, P330, 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:502.0
XLogP3:5.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:501.0559314
Monoisotopic Mass:501.0559314
Topological Polar Surface Area:115
Heavy Atom Count:32
Complexity:769
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(3-ethyl-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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