2-[(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]phthalazin-1-one
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![2-[(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]phthalazin-1-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/b14821dd9757487b99feb4bcb69fe61f.png "2-[(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]phthalazin-1-one")
2-[(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]phthalazin-1-one
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CAS No:
728034-98-8
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Formula:
C12H11N5OS
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Chemical Name:
2-[(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]phthalazin-1-one
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Synonyms:
ZINC6083204;STK782210;STK848172;AKOS001732937;AKOS005628023;MCULE-3625341065;SR-01000304631;SR-01000304631-1;2-[(4-methyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)methyl]phthalazin-1(2H)-one;2-[(4-methyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl]phthalazin-1(2H)-one;2-[(5-mercapto-4-methyl-4H-1,2,4-triazol-3-yl)methyl]phthalazin-1(2H)-one;728034-98-8
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CAS No:
2-[(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]phthalazin-1-one Basic Attributes
273.32 g/mol
273.06843116 g/mol
Computed Properties
Molecular Weight:273.32
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:273.06843116
Monoisotopic Mass:273.06843116
Topological Polar Surface Area:92.4
Heavy Atom Count:19
Complexity:475
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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