Basic information
- CAS
119422-08-1- Standard SMILES
CCNCCCCNCCCCNCCCCNCC- InChIKey
QXOCYGPVDXDFLC-UHFFFAOYSA-N- Molecular formula
- C16H38N4
- Average molar mass
- 286.5 g/mol
- Monoisotopic mass
- 286.30964723
Overview
Diethylhomospermine has been used in trials studying the treatment of Diarrhea and HIV Infections.
Names & identifiers
- Preferred name
- N1,N4-Bis(4-(ethylamino)butyl)-1,4-butanediamine
- IUPAC
- N-ethyl-N'-[4-[4-(ethylamino)butylamino]butyl]butane-1,4-diamine
- English name
- N(1),N(14)-bis(ethyl)homospermine
- Molecular formula
- C16H38N4
- Molecular weight
- 286.5
Names & synonyms
Diethylhomospermine119422-08-1DEHSPMBEHSpmN(1),N(14)-Bis(ethyl)homospermine1,14-Bis(ethylamino)-5,10-diazatetradecanedehopBE-4-4-4N(1),N(14)-diethylhomospermineN1,N14-diethylhomospermine8G6X94GNHONSC-741423
Show more names
DE-444N,N'-Diethyl-5,10-diazatetradecane-1,14-diamineN,N'-Bis[4-(ethylamino)butyl]tetramethylenediamine
DTXSID201524591,4-Butanediamine, N,N'-bis(4-(ethylamino)butyl)-N1,N4-Bis(4-(ethylamino)butyl)-1,4-butanediamine3,8,13,18-TETRAAZAICOSANERefChem:927363N1N14-diethylhomospermineN1N14-bis(ethyl)norspermineDTXCID2074950
Database identifiers
- CAS
119422-08-1- PubChem CID
- 60702
- DTXSID
DTXSID20152459- ChEMBL
CHEMBL77101- UNII
- 8G6X94GNHO
- Nikkaji
- J415.690K
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 48.1 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 17
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 147
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physicochemical properties
- Boiling point
- 418.86 °C · 418.86°C (rough estimate)
- Density
- 0.8603 · 0.8603 (rough estimate)
- refractive index
- 1.485 · 1.4850 (estimate)
- FDA UNII
- 8 G6X94GNHO · 8G6X94GNHO
- Symbol(GHS)
- 5 · GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 302 · H302-H310-H314-H317
- Precautionary statements
- 280 · P280-P301+P312+P330-P301+P330+P331-P303+P361+P353-P305+P351+P338+P310
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06
- Hazard statements
- H302-H310-H314-H317
- Precautionary statements
- P280-P301+P312+P330-P301+P330+P331-P303+P361+P353-P305+P351+P338+P310
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Drugs used in the treatment of acute or chronic vascular HYPERTENSION regardless of pharmacological mechanism. Among the antihypertensive agents are DIURETICS; (especially DIURETICS, THIAZIDE); ADRENERGIC BETA-ANTAGONISTS; ADRENERGIC ALPHA-ANTAGONISTS; ANGIOTENSIN-CONVERTING ENZYME INHIBITORS; CALCIUM CHANNEL BLOCKERS; GANGLIONIC BLOCKERS; and VASODILATOR AGENTS.
Substances that inhibit or prevent the proliferation of NEOPLASMS.
Drugs used to potentiate the effectiveness of radiation therapy in destroying unwanted cells.
Applications
UsesDiethylhomospermine is a polyamine analogue. Diethylhomospermine has antitumor and antidiarrheal activity[1].
Suppliers5 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
United Life Science020-82099279 18988968278 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海超岚化工科技中心（原宁波市超明生物科技有限公司）13301662590 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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