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N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide

N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide structure

CAS No:
618880-64-1
Formula:
C25H17ClF6N4O2S
Chemical Name:
N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Synonyms:
N-[3,5-bis(trifluoromethyl)phenyl]-2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide;ZINC1739843;STL051877;AKOS002191030;MCULE-4090889795;ST50085447;618880-64-1;N-(3,5-Bis(trifluoromethyl)phenyl)-2-((4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)acetamide;N-[3,5-bis(trifluoromethyl)phenyl]-2-[4-(4-chlorophenyl)-5-(4-methoxyphenyl)(1 ,2,4-triazol-3-ylthio)]acetamide

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N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Basic Attributes

Molecular Weight：

586.9 g/mol

Exact Mass：

586.0664936 g/mol

Characteristics

PSA：

94.3 Å²

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, 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:586.9
XLogP3:6.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:7
Exact Mass:586.0664936
Monoisotopic Mass:586.0664936
Topological Polar Surface Area:94.3
Heavy Atom Count:39
Complexity:786
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide

Basic Attributes
Characteristics
Safety Information
Computed Properties

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