1,3-Indandiol, 2-(3-(4-(m-chlorophenyl)-1-piperazinyl)propyl)-2-phenyl-
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Basic information
- CAS
31805-09-1- Standard SMILES
OC1c2ccccc2C(O)C1(CCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1- InChIKey
NMBDNONTUMMICB-UHFFFAOYSA-N- Molecular formula
- C28H31ClN2O2
- Average molar mass
- 463 g/mol
- Monoisotopic mass
- 462.2074059
Names & identifiers
- Preferred name
- 1,3-Indandiol, 2-(3-(4-(m-chlorophenyl)-1-piperazinyl)propyl)-2-phenyl-
- IUPAC
- 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-2-phenyl-1,3-dihydroindene-1,3-diol
- English name
- 2-[3-[4-(m-Chlorophenyl)-1-piperazinyl]propyl]-2-phenyl-1,3-indanediol
- Molecular formula
- C28H31ClN2O2
- Molecular weight
- 463.01
Names & synonyms
31805-09-11,3-Indandiol, 2-(3-(4-(m-chlorophenyl)-1-piperazinyl)propyl)-2-phenyl-2-(3-(4-(m-Chlorophenyl)-1-piperazinyl)propyl)-2-phenyl-indandiol-1,3RefChem:2192382-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-phenyl-2,3-dihydro-1h-indene-1,3-diolDTXSID309537372-[3-[4-(m-Chlorophenyl)-1-piperazinyl]propyl]-2-phenyl-1,3-indanediolDB-2605692-[3-[4-(M-chlorophenyl)-1-piperazinyl ]propyl ]-2-phenyl-1,3-indanediol1H-Indene-1,3-diol, 2-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-2,3-dihydro-2-phenyl-
Database identifiers
- CAS
31805-09-1- PubChem CID
- 208236
- DTXSID
DTXSID30953737- Nikkaji
- J127.603D
Properties
Computed structural propertiesFilling in
- XLogP
- 4.7
- Topological polar surface area
- 46.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 601
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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