Cas no 212832-16-1 (1-Piperazinepropanamine, N,N-bis(4-fluorophenyl)-)
212832-16-1 structure
Product Name:1-Piperazinepropanamine, N,N-bis(4-fluorophenyl)-
CAS No:212832-16-1
MF:C19H23F2N3
MW:331.402831315994
CID:1403716
PubChem ID:11034920
Update Time:2025-04-20
1-Piperazinepropanamine, N,N-bis(4-fluorophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1-Piperazinepropanamine, N,N-bis(4-fluorophenyl)-
- 4-fluoro-N-(4-fluorophenyl)-N-(3-piperazin-1-ylpropyl)aniline
- Bis-(4-fluoro-phenyl)-(3-piperazin-1-yl-propyl)-amine
- BDBM50129596
- SCHEMBL8011417
- 212832-16-1
- DTXSID50452797
- CHEMBL315166
-
- Inchi： 1S/C19H23F2N3/c20-16-2-6-18(7-3-16)24(19-8-4-17(21)5-9-19)13-1-12-23-14-10-22-11-15-23/h2-9,22H,1,10-15H2
- InChI Key： LRJWNYKCDTWXAG-UHFFFAOYSA-N
- SMILES： FC1C=CC(=CC=1)N(C1C=CC(=CC=1)F)CCCN1CCNCC1
Computed Properties
- Exact Mass: 331.18619
- Monoisotopic Mass: 331.18600407g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 24
- Rotatable Bond Count: 6
- Complexity: 325
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.5
- Topological Polar Surface Area: 18.5?2
Experimental Properties
- PSA: 18.51
1-Piperazinepropanamine, N,N-bis(4-fluorophenyl)- Related Literature
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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