Basic information
- CAS
93035-08-6- Standard SMILES
COc1ccc(C(=O)CN2CCN(C(c3ccccc3)c3ccccc3)CC2)c(OC)c1- InChIKey
YQYPRPQQPSCZJD-UHFFFAOYSA-N- Molecular formula
- C27H30N2O3
- Average molar mass
- 430.5 g/mol
- Monoisotopic mass
- 430.22564282
Names & identifiers
- Preferred name
- Ethanone, 1-(2,4-dimethoxyphenyl)-2-[4-(diphenylmethyl)-1-piperazinyl]-
- IUPAC
- 2-(4-benzhydrylpiperazin-1-yl)-1-(2,4-dimethoxyphenyl)ethanone
Names & synonyms
93035-08-6Ethanone, 1-(2,4-dimethoxyphenyl)-2-[4-(diphenylmethyl)-1-piperazinyl]-SCHEMBL10984399DTXSID504351661-(2,4-Dimethoxyphenyl)-2-[4-(diphenylmethyl)piperazin-1-yl]ethan-1-one
Database identifiers
- CAS
93035-08-6- PubChem CID
- 10071354
- DTXSID
DTXSID50435166
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 547
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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