1-[[(1-amino-2-sulfosulfanylethylidene)amino]methyl]-3-(4-methylphenyl)adamantane
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1-[[(1-amino-2-sulfosulfanylethylidene)amino]methyl]-3-(4-methylphenyl)adamantane
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CAS No:
117101-76-5
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Formula:
C20H28N2O3S2
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Chemical Name:
1-[[(1-amino-2-sulfosulfanylethylidene)amino]methyl]-3-(4-methylphenyl)adamantane
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Synonyms:
117101-76-5;BRN 5162791;N-(3-(4-Tolyl)adamant-1-ylmethyl)acetamidinothiosulfuric acid;Thiosulfuric acid, S-(2-(((3-(4-methylphenyl)tricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester;DTXSID10922289;S-[2-Imino-2-({[3-(4-methylphenyl)adamantan-1-yl]methyl}amino)ethyl] hydrogen sulfurothioate
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CAS No:
1-[[(1-amino-2-sulfosulfanylethylidene)amino]methyl]-3-(4-methylphenyl)adamantane Basic Attributes
408.6 g/mol
408.15413511 g/mol
Computed Properties
Molecular Weight:408.6
XLogP3:3.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:408.15413511
Monoisotopic Mass:408.15413511
Topological Polar Surface Area:126
Heavy Atom Count:27
Complexity:679
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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