Basic information
- Standard SMILES
COc1c(C)c(CNCCCN2CCN(CCCNCc3c(C)c(OC)c(OC)c(OC)c3OC)CC2)c(OC)c(OC)c1OC- InChIKey
GGXXSNUBTLVIDH-UHFFFAOYSA-N- Molecular formula
- C34H56N4O8
- Average molar mass
- 648.8 g/mol
- Monoisotopic mass
- 648.40981476
Names & identifiers
- Preferred name
- N,N'-bis{[N-(2,3,4,5-tetramethoxy-6-methylbenzyl)]-3-aminopropyl}piperazine
- IUPAC
- N-[(2,3,4,5-tetramethoxy-6-methylphenyl)methyl]-3-[4-[3-[(2,3,4,5-tetramethoxy-6-methylphenyl)methylamino]propyl]piperazin-1-yl]propan-1-amine
Names & synonyms
SCHEMBL8317768GGXXSNUBTLVIDH-UHFFFAOYSA-NN,N'-bis{[N-(2,3,4,5-tetramethoxy-6-methylbenzyl)]-3-aminopropyl}piperazine
Database identifiers
- PubChem CID
- 86752610
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 20
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 745
Related reactions
1 records
Compound notes
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