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N-(2-chloro-4,6-dimethylphenyl)-2-[(4-ethyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide

N-(2-chloro-4,6-dimethylphenyl)-2-[(4-ethyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide structure

CAS No:
585551-40-2
Formula:
C18H19ClN6OS
Chemical Name:
N-(2-chloro-4,6-dimethylphenyl)-2-[(4-ethyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Synonyms:
585551-40-2;ZINC2391401;STL341770;AKOS002188195;MCULE-8661836013;N-(2-chloro-4,6-dimethylphenyl)-2-{[4-ethyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide;ST50081218;N-(2-Chloro-4,6-dimethylphenyl)-2-((4-ethyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide;N-(2-chloro-4,6-dimethylphenyl)-2-(4-ethyl-5-pyrazin-2-yl(1,2,4-triazol-3-ylth io))acetamide;N-(2-CHLORO-4,6-DIMETHYLPHENYL)-2-{[4-ETHYL-5-(2-PYRAZINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE

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N-(2-chloro-4,6-dimethylphenyl)-2-[(4-ethyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Basic Attributes

Molecular Weight：

402.9 g/mol

Exact Mass：

402.1029581 g/mol

Characteristics

PSA：

111 Å²

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, 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:402.9
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:402.1029581
Monoisotopic Mass:402.1029581
Topological Polar Surface Area:111
Heavy Atom Count:27
Complexity:501
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(2-chloro-4,6-dimethylphenyl)-2-[(4-ethyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide

Basic Attributes
Characteristics
Safety Information
Computed Properties

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