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

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

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

CAS No:
477329-19-4
Formula:
C25H21F2N3O3S2
Chemical Name:
N-(3,4-difluorophenyl)-2-[[3-(4-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide
Synonyms:
N-(3,4-difluorophenyl)-2-{[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide;477329-19-4;ZINC1794061;STK023041;AKOS002174140;MCULE-2136222884;ST50060293;N-(3,4-Difluorophenyl)-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-(3,4-difluorophenyl)-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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N-(3,4-difluorophenyl)-2-[[3-(4-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide Basic Attributes

Molecular Weight：

513.6 g/mol

Exact Mass：

513.09924021 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:513.6
XLogP3:5.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:513.09924021
Monoisotopic Mass:513.09924021
Topological Polar Surface Area:125
Heavy Atom Count:35
Complexity:826
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(3,4-difluorophenyl)-2-[[3-(4-methoxyphenyl)-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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