Basic information
- CAS
118090-03-2- Standard SMILES
O=C1NCCN2CCNC(=O)NCCN(CCN1)CCNC(=O)NCC2- InChIKey
WEVWYSMEMRSUHI-UHFFFAOYSA-N- Molecular formula
- C15H30N8O3
- Average molar mass
- 370.45 g/mol
- Monoisotopic mass
- 370.24408685
Names & identifiers
- Preferred name
- 1,4,6,9,12,14,19,21-Octaazabicyclo[7.7.7]tricosane-5,13,20-trione
- IUPAC
- 1,4,6,9,12,14,19,21-octazabicyclo[7.7.7]tricosane-5,13,20-trione
Names & synonyms
1,4,6,9,12,14,19,21-Octaazabicyclo[7.7.7]tricosane-5,13,20-trione118090-03-2DTXSID10443585
Database identifiers
- CAS
118090-03-2- PubChem CID
- 10690534
- DTXSID
DTXSID10443585- Nikkaji
- J786.051J
Properties
Computed structural properties
- XLogP
- -2.7
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 373
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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