Spermine tetrapfp
Basic information
- CAS
71387-78-5- Standard SMILES
O=C(NCCCN(CCCCN(CCCNC(=O)C(F)(F)C(F)(F)F)C(=O)C(F)(F)C(F)(F)F)C(=O)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F- InChIKey
KNQDHULDWDMPFS-UHFFFAOYSA-N- Molecular formula
- C22H22F20N4O4
- Average molar mass
- 786.4 g/mol
- Monoisotopic mass
- 786.1321684
Names & identifiers
- Preferred name
- Spermine tetrapfp
- IUPAC
- 2,2,3,3,3-pentafluoro-N-[3-[2,2,3,3,3-pentafluoropropanoyl-[4-[2,2,3,3,3-pentafluoropropanoyl-[3-(2,2,3,3,3-pentafluoropropanoylamino)propyl]amino]butyl]amino]propyl]propanamide
Names & synonyms
Spermine tetrapfpKNQDHULDWDMPFS-UHFFFAOYSA-NDTXSID50104529471387-78-52,2,3,3,3-Pentafluoro-N-(3-[(2,2,3,3,3-pentafluoropropanoyl)amino]propyl)-N-[4-((2,2,3,3,3-pentafluoropropanoyl)(3-[(2,2,3,3,3-pentafluoropropanoyl)amino]propyl)amino)butyl]propanamide #N-[3-[(Perfluoropropanoyl)-[4-[(perfluoropropanoyl)-[3-(perfluoropropanoyl)aminopropyl]amino]butyl]amino]propyl]perfluoropropanamide
Database identifiers
- CAS
71387-78-5- PubChem CID
- 609309
- DTXSID
DTXSID501045294- Nikkaji
- J543.280D
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 98.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 24
- Rotatable bonds
- 17
- Heavy atoms
- 50
- Formal charge
- 0
- Complexity
- 1,090
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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