Basic information
- CAS
63716-19-8- Standard SMILES
CCC(=O)Oc1ccc(OCC(O)CN2CCN(c3ccccc3)CC2)cc1- InChIKey
CUYFBDNSBSBVCF-UHFFFAOYSA-N- Molecular formula
- C22H28N2O4
- Average molar mass
- 384.5 g/mol
- Monoisotopic mass
- 384.20490738
Names & identifiers
- Preferred name
- 2-Propanol, 3-(4-phenylpiperazinyl)-1-(4-propionyloxyphenoxy)-
- IUPAC
- [4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]phenyl] propanoate
- English name
- 3-(4-Phenyl-1-piperazinyl)-1-[4-(propionyloxy)phenoxy]-2-propanol
- Molecular weight
- 0
Names & synonyms
63716-19-83-(4-Phenylpiperazinyl)-1-(4-propionyloxyphenoxy)propan-2-ol2-Propanol, 3-(4-phenylpiperazinyl)-1-(4-propionyloxyphenoxy)-RefChem:265970[4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]phenyl] propanoate3-(4-Phenyl-1-piperazinyl)-1-[4-(propionyloxy)phenoxy]-2-propanolDTXSID609800764-[2-Hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]phenyl propanoateDB-324264
Database identifiers
- CAS
63716-19-8- PubChem CID
- 113754
- DTXSID
DTXSID60980076- Nikkaji
- J87.499J
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 62.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 453
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…