Basic information
- CAS
63938-65-8- Standard SMILES
COc1ccccc1N1CCN(CCc2c(C)[nH]c3ccc(OC)c(C)c23)CC1.Cl.Cl- InChIKey
PNLZHYPFGUQAEB-UHFFFAOYSA-N- Molecular formula
- C24H33Cl2N3O2
- Average molar mass
- 466.4 g/mol
- Monoisotopic mass
- 465.1949827
Names & identifiers
- Preferred name
- Indole, 2,4-dimethyl-5-methoxy-3-(2-(4-(o-methoxyphenyl)-1-piperazinyl)ethyl)-, dihydrochloride, hemihydrate
- IUPAC
- 5-methoxy-3-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-2,4-dimethyl-1H-indole;dihydrochloride
Names & synonyms
63938-65-8Indole, 2,4-dimethyl-5-methoxy-3-(2-(4-(o-methoxyphenyl)-1-piperazinyl)ethyl)-, dihydrochloride, hemihydrateDTXSID602137705-Methoxy-3-(2-(4-(o-methoxyphenyl)-1-piperazinyl)ethyl)-2,4-dimethylindole dihydrochlorideRefChem:349167DTXCID901362615-Methoxy-3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl}-2,4-dimethyl-1H-indole--hydrogen chloride (1/2)
Database identifiers
- CAS
63938-65-8- PubChem CID
- 45598
- DTXSID
DTXSID60213770
Properties
Computed structural properties
- Topological polar surface area
- 40.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 510
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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