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2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(prop-2-enylcarbamoyl)acetamide

2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(prop-2-enylcarbamoyl)acetamide structure

CAS No:
735298-40-5
Formula:
C10H12F3N5O2S
Chemical Name:
2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(prop-2-enylcarbamoyl)acetamide
Synonyms:
MLS000517465;CHEMBL1540003;HMS2688H24;ZINC3289224;AKOS033933452;MCULE-5403700081;SMR000343542;Z25112100;1-(2-{[4-methyl-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-3-(prop-2-en-1-yl)urea;735298-40-5

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2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(prop-2-enylcarbamoyl)acetamide Basic Attributes

Molecular Weight：

323.30 g/mol

Exact Mass：

323.06638030 g/mol

Characteristics

PSA：

114 Å²

Water Solubility：

>48.5 [ug/mL]

Computed Properties

Molecular Weight:323.30
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:323.06638030
Monoisotopic Mass:323.06638030
Topological Polar Surface Area:114
Heavy Atom Count:21
Complexity:407
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(prop-2-enylcarbamoyl)acetamide

Basic Attributes
Characteristics
Computed Properties

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