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2,2'-Dithiobis(N-((1-adamantyl)methyl)acetamidine) dihydrochloride

HCID 64319
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Basic information

CAS
37764-44-6
Standard SMILES
Cl.Cl.NC(CSSCC(N)=NCC12CC3CC(CC(C3)C1)C2)=NCC12CC3CC(CC(C3)C1)C2
InChIKey
BJQWQXYAGVJFKP-UHFFFAOYSA-N
Molecular formula
C26H44Cl2N4S2
Average molar mass
547.7 g/mol
Monoisotopic mass
546.2384452

Names & identifiers

Preferred name
2,2'-Dithiobis(N-((1-adamantyl)methyl)acetamidine) dihydrochloride
IUPAC
N'-(1-adamantylmethyl)-2-[[2-(1-adamantylmethylimino)-2-aminoethyl]disulfanyl]ethanimidamide;dihydrochloride

Names & synonyms

37764-44-6S 752,2-Dithiobis(N-(1-adamantyl)methyl)acetamide2,2'-Dithiobis(N-((1-adamantyl)methyl)acetamidine) dihydrochlorideS 75 (radioprotective)N'-(1-adamantylmethyl)-2-[[2-(1-adamantylmethylimino)-2-aminoethyl]disulfanyl]ethanimidamide;dihydrochlorideNSC 194271SCHEMBL115336212,2'-disulfanediylbis(N-(adamantan-1-ylmethyl)acetimidamide) dihydrochlorideS-75HY-1237342,2-dithiobis(N-((1-adamantyl)methyl)acetamide) hydrochloride
Show more names
Ethanimidamide, 2,2'-dithiobis(N-(tricyclo(3.3.1.13,7)dec-1-ylmethyl)-, dihydrochloride

Database identifiers

CAS
37764-44-6
PubChem CID
64319

Properties

Computed structural properties

Topological polar surface area
127 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
4
Rotatable bonds
9
Heavy atoms
34
Formal charge
0
Complexity
629

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