[3-Methyl-4-(3-methylphenyl)piperazin-1-yl]-naphthalen-2-ylmethanone
Basic information
- CAS
851877-84-4- Standard SMILES
Cc1cccc(N2CCN(C(=O)c3ccc4ccccc4c3)CC2C)c1- InChIKey
LKRAROZKGYJCDM-UHFFFAOYSA-N- Molecular formula
- C23H24N2O
- Average molar mass
- 344.4 g/mol
- Monoisotopic mass
- 344.18886339
Names & identifiers
- Preferred name
- [3-Methyl-4-(3-methylphenyl)piperazin-1-yl]-naphthalen-2-ylmethanone
- IUPAC
- [3-methyl-4-(3-methylphenyl)piperazin-1-yl]-naphthalen-2-ylmethanone
Names & synonyms
[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-naphthalen-2-ylmethanoneMLS002245716CHEMBL1730576DTXSID701328432HMS3090F21AKOS033968233851877-84-4SMR001309358Z26558534[3-Methyl-4-(3-methylphenyl)piperazin-1-yl](naphthalen-2-yl)methanone
Database identifiers
- CAS
851877-84-4- PubChem CID
- 4884399
- DTXSID
DTXSID701328432- ChEMBL
CHEMBL1730576
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 493
Experimental & physicochemical properties
Solubility7.4 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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