4-(4-methylphenyl)-3-(phenoxymethyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole
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![4-(4-methylphenyl)-3-(phenoxymethyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/4466f203233b49b3b2ad7e97f0bec829.png "4-(4-methylphenyl)-3-(phenoxymethyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole")
4-(4-methylphenyl)-3-(phenoxymethyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole
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CAS No:
899409-63-3
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Formula:
C25H23N3OS
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Chemical Name:
4-(4-methylphenyl)-3-(phenoxymethyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole
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Synonyms:
ZINC2342751;STK581152;AKOS005504530;4-(4-methylphenyl)-3-(phenoxymethyl)-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole;ST50416511;{[5-((2E)-3-phenylprop-2-enylthio)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]metho xy}benzene;899409-63-3
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CAS No:
4-(4-methylphenyl)-3-(phenoxymethyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole Basic Attributes
413.5 g/mol
413.15618354 g/mol
Computed Properties
Molecular Weight:413.5
XLogP3:5.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:413.15618354
Monoisotopic Mass:413.15618354
Topological Polar Surface Area:65.2
Heavy Atom Count:30
Complexity:511
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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