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ethyl 2-[[4-(2-phenylethyl)-5-[(thiophene-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate

ethyl 2-[[4-(2-phenylethyl)-5-[(thiophene-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate structure

CAS No:
689748-66-1
Formula:
C20H22N4O3S2
Chemical Name:
ethyl 2-[[4-(2-phenylethyl)-5-[(thiophene-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate
Synonyms:
689748-66-1;ethyl 2-((4-phenethyl-5-((thiophene-2-carboxamido)methyl)-4H-1,2,4-triazol-3-yl)thio)acetate;ethyl 2-{[4-(2-phenylethyl)-5-{[(thiophen-2-yl)formamido]methyl}-4H-1,2,4-triazol-3-yl]sulfanyl}acetate;MLS000087557;CHEMBL1495365;HMS2451I16;ZINC2724032;AKOS024586362;MCULE-5651927924;SMR000023779;SR-01000123018;SR-01000123018-1;F0601-0046;ethyl [(4-(2-phenylethyl)-5-{[(thien-2-ylcarbonyl)amino]methyl}-4H-1,2,4-triazol-3-yl)thio]acetate;ethyl 2-[[4-(2-phenylethyl)-5-[(thiophene-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate

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ethyl 2-[[4-(2-phenylethyl)-5-[(thiophene-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate Basic Attributes

Molecular Weight：

430.5 g/mol

Exact Mass：

430.11333292 g/mol

Characteristics

PSA：

140 Å²

Computed Properties

Molecular Weight:430.5
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:11
Exact Mass:430.11333292
Monoisotopic Mass:430.11333292
Topological Polar Surface Area:140
Heavy Atom Count:29
Complexity:534
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-[[4-(2-phenylethyl)-5-[(thiophene-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate

Basic Attributes
Characteristics
Computed Properties
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