N2-[2-[2-[(4,6-diamino-1,3,5-triazin-2-yl)amino]ethyldisulfanyl]ethyl]-1,3,5-triazine-2,4,6-triamine
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Basic information
- Standard SMILES
Nc1nc(N)nc(NCCSSCCNc2nc(N)nc(N)n2)n1- InChIKey
NOMMEZDOLYKVTB-UHFFFAOYSA-N- Molecular formula
- C10H18N12S2
- Average molar mass
- 370.5 g/mol
- Monoisotopic mass
- 370.12188097
Names & identifiers
- Preferred name
- N2-[2-[2-[(4,6-diamino-1,3,5-triazin-2-yl)amino]ethyldisulfanyl]ethyl]-1,3,5-triazine-2,4,6-triamine
- IUPAC
- 2-N-[2-[2-[(4,6-diamino-1,3,5-triazin-2-yl)amino]ethyldisulfanyl]ethyl]-1,3,5-triazine-2,4,6-triamine
Names & synonyms
NSC273894NSC-273894N~2~-(2-((2-((4,6-Diamino-1,3,5-triazin-2-yl)amino)ethyl)dithio)ethyl)-1,3,5-triazine-2,4,6-triamineN2-[2-[2-[(4,6-diamino-1,3,5-triazin-2-yl)amino]ethyldisulfanyl]ethyl]-1,3,5-triazine-2,4,6-triamine
Database identifiers
- PubChem CID
- 321606
- Nikkaji
- J3.105.668C
Properties
Computed structural propertiesFilling in
- XLogP
- -0.4
- Topological polar surface area
- 256 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 300
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Compound notes
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