Basic information
- CAS
112891-97-1- Standard SMILES
CCCN(CCC)C1Cc2cccc3cc(O)cc(c23)C1- InChIKey
TWUJBHBRYYTEDL-UHFFFAOYSA-N- Molecular formula
- C19H25NO
- Average molar mass
- 283.4 g/mol
- Monoisotopic mass
- 283.19361442
Overview
Alentemol is an ortho- and peri-fused tricyclic hydrocarbon.
Names & identifiers
- Preferred name
- Alentemol
- IUPAC
- 5-(dipropylamino)-5,6-dihydro-4H-phenalen-2-ol
- English name
- Alentemol
- Molecular formula
- C19H25NO
- Molecular weight
- 283.41
Names & synonyms
ALENTEMOL112891-97-1Alentemol [INN]UNII-F6S91MHL3EF6S91MHL3E(+)-2-(DIPROPYLAMINO)-2,3-DIHYDROPHENALEN-5-OL1H-PHENALEN-5-OL, 2-(DIPROPYLAMINO)-2,3-DIHYDRO-, (+)-alentemolumRefChem:1106595-(dipropylamino)-5,6-dihydro-4H-phenalen-2-ol2-(dipropylamino)-2,3-dihydro-1h-phenalen-5-olorb1738073
Show more names
(+)-2,3-Dihydro-2-(dipropylamino)-1H-phenalen-5-ol
CHEMBL2104081SCHEMBL10533249SCHEMBL29377508DTXSID80869556CHEBI:191243NS00125535Q15633922
Database identifiers
- CAS
112891-97-1- PubChem CID
- 60574
- DTXSID
DTXSID80869556- ChEMBL
CHEMBL2104081- ChEBI
CHEBI:191243- UNII
- F6S91MHL3E
- Nikkaji
- J343.214I、J402.771J
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 326
Physicochemical properties
- FDA UNII
- 6 S91MHL3E · F6S91MHL3E
Chemistry & industry
Applications
UsesAntipsychotic; dopamine agonist.
Suppliers2 total
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Additional notes
DefinitionChEBI: Alentemol is an ortho- and peri-fused tricyclic hydrocarbon.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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