1-[[4-amino-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3,3-dimethylbutan-2-one
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1-[[4-amino-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3,3-dimethylbutan-2-one
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CAS No:
730246-61-4
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Formula:
C19H22N4OS
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Chemical Name:
1-[[4-amino-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3,3-dimethylbutan-2-one
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Synonyms:
ZINC3294739;AKOS034438116;MCULE-6558869168;Z53790266;1-({4-amino-5-[(naphthalen-1-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-3,3-dimethylbutan-2-one;730246-61-4
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CAS No:
1-[[4-amino-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3,3-dimethylbutan-2-one Basic Attributes
354.5 g/mol
354.15143251 g/mol
Computed Properties
Molecular Weight:354.5
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:354.15143251
Monoisotopic Mass:354.15143251
Topological Polar Surface Area:99.1
Heavy Atom Count:25
Complexity:467
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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