Basic information
- CAS
147510-59-6- Standard SMILES
CCNCCCCNCCCCNCCCCNCCCCNCC- InChIKey
NPPQUDMGFNXAFH-UHFFFAOYSA-N- Molecular formula
- C20H47N5
- Average molar mass
- 357.6 g/mol
- Monoisotopic mass
- 357.38314652
Overview
structure given in first source
Names & identifiers
- Preferred name
- BE 4-4-4-4
- IUPAC
- N-ethyl-N'-[4-[4-[4-(ethylamino)butylamino]butylamino]butyl]butane-1,4-diamine
- English name
- Be 4-4-4-4
- Molecular formula
- C20H47N5
- Molecular weight
- 357.62
Names & synonyms
3,8,13,18,23-Pentaazapentacosane147510-59-6BE 4-4-4-4DTXSID50163735RefChem:116802BE-4-4-4-4DTXCID4086226BE 4444BE-4444N-ethyl-N'-[4-[4-[4-(ethylamino)butylamino]butylamino]butyl]butane-1,4-diamine1,19-Bis(ethylamino)-5,10,15-triazanonadecanePapc-hcl
Show more names
1,4-Butanediamine, N1-[4-(ethylamino)butyl]-N4-[4-[[4-(ethylamino)butyl]amino]butyl]-
NSC640506NCIMech_000262SCHEMBL429223CHEMBL551489BDBM86161BE4444PDSP1_000333PDSP2_000331
Database identifiers
- CAS
147510-59-6- PubChem CID
- 368998
- DTXSID
DTXSID50163735- ChEMBL
CHEMBL551489- Nikkaji
- J549.421D
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 60.2 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 22
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 204
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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