3-(4-allyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)-1-(3-chlorobenzyl)-2(1H)-pyridinone
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3-(4-allyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)-1-(3-chlorobenzyl)-2(1H)-pyridinone
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CAS No:
242472-30-6
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Formula:
C17H15ClN4OS
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Chemical Name:
3-(4-allyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)-1-(3-chlorobenzyl)-2(1H)-pyridinone
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Synonyms:
3-(4-allyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)-1-(3-chlorobenzyl)-2(1H)-pyridinone;1-[(3-chlorophenyl)methyl]-3-[4-(prop-2-en-1-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]-1,2-dihydropyridin-2-one;ZINC01384896;MLS000327525;CHEMBL1391441;KS-00001QIH;HMS2398C08;ZINC5624820;AKOS005074309;MCULE-6672284635
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CAS No:
3-(4-allyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)-1-(3-chlorobenzyl)-2(1H)-pyridinone Basic Attributes
358.85
358.066
Computed Properties
Molecular Weight:358.8
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:358.0655100
Monoisotopic Mass:358.0655100
Topological Polar Surface Area:80
Heavy Atom Count:24
Complexity:643
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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