(4-tert-butyl-2,6-dimethylphenyl)methyl 4-(5-methylsulfanyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)benzoate
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(4-tert-butyl-2,6-dimethylphenyl)methyl 4-(5-methylsulfanyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)benzoate
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CAS No:
794571-72-5
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Formula:
C23H26N2O2S3
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Chemical Name:
(4-tert-butyl-2,6-dimethylphenyl)methyl 4-(5-methylsulfanyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)benzoate
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Synonyms:
CHEMBL4541209;ZINC3324827;AKOS033722269;MCULE-8718678574;Z19964752;(4-tert-butyl-2,6-dimethylphenyl)methyl 4-[5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro-1,3,4-thiadiazol-3-yl]benzoate;794571-72-5
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CAS No:
(4-tert-butyl-2,6-dimethylphenyl)methyl 4-(5-methylsulfanyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)benzoate Basic Attributes
458.7 g/mol
458.11564160 g/mol
Computed Properties
Molecular Weight:458.7
XLogP3:7.3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:458.11564160
Monoisotopic Mass:458.11564160
Topological Polar Surface Area:125
Heavy Atom Count:30
Complexity:656
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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