Basic information
- CAS
22012-12-0- Standard SMILES
C1=C(N2CCN(Cc3ccccc3)CC2)c2ccccc2Oc2ccccc21- InChIKey
DAIFUBZGVLMNNK-UHFFFAOYSA-N- Molecular formula
- C25H24N2O
- Average molar mass
- 368.5 g/mol
- Monoisotopic mass
- 368.18886339
Names & identifiers
- Preferred name
- Piperazine, 1-benzyl-4-dibenz(b,f)oxepin-10-yl-
- IUPAC
- 1-benzo[b][1]benzoxepin-5-yl-4-benzylpiperazine
Names & synonyms
RMI 609501-Benzyl-4-dibenz(b,f)oxepin-10-ylpiperazine22012-12-0BRN 0578372DTXSID20176458Piperazine, 1-benzyl-4-dibenz(b,f)oxepin-10-yl-1-Dibenz(b,f)oxepin-10-yl-4-(phenylmethyl)piperazinePiperazine, 1-dibenz(b,f)oxepin-10-yl-4-(phenylmethyl)-RefChem:372554DTXCID3098949Piperazine, 1-benzyl-4-dibenz(b,f)oxepin-10-yl-(8CI)1-benzyl-4-(dibenzo[b,f]oxepin-10-yl)piperazine
Show more names
Piperazine, 1-benzyl-4-dibenz(b,f)oxepin-10-yl- (8CI)
Database identifiers
- CAS
22012-12-0- PubChem CID
- 210962
- DTXSID
DTXSID20176458
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 15.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 533
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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