4-[3-(Trifluoromethyl)phenyl]piperidine - CAS 32860-17-6
Catalog: |
BB021442 |
Product Name: |
4-[3-(Trifluoromethyl)phenyl]piperidine |
CAS: |
32860-17-6 |
Synonyms: |
4-[3-(trifluoromethyl)phenyl]piperidine; 4-[3-(trifluoromethyl)phenyl]piperidine |
IUPAC Name: | 4-[3-(trifluoromethyl)phenyl]piperidine |
Description: | 4-[3-(Trifluoromethyl)phenyl]piperidine (CAS# 32860-17-6) is a useful research chemical. |
Molecular Weight: | 229.24 |
Molecular Formula: | C12H14F3N |
Canonical SMILES: | C1CNCCC1C2=CC(=CC=C2)C(F)(F)F |
InChI: | InChI=1S/C12H14F3N/c13-12(14,15)11-3-1-2-10(8-11)9-4-6-16-7-5-9/h1-3,8-9,16H,4-7H2 |
InChI Key: | IPKSNWXGEIHOMR-UHFFFAOYSA-N |
LogP: | 3.50120 |
Publication Number | Title | Priority Date |
CN-108601769-A | Pyrazole compound and its preparation and application | 20151120 |
WO-2016187393-A1 | Ccr2 modulators | 20150521 |
CN-106470990-A | Pyridazine compound | 20140312 |
WO-2015028848-A1 | Bicyclic heterocyclic compounds as multi-kinase inhibitors | 20130902 |
EP-2924032-A1 | Benzo five-membered nitrogen heterocyclic piperidine or piperazine derivatives and preparation methods and pharmaceutical compositions thereof | 20121126 |
PMID | Publication Date | Title | Journal |
22479344 | 20120101 | Structural insights from binding poses of CCR2 and CCR5 with clinically important antagonists: a combined in silico study | PloS one |
Complexity: | 221 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 229.10783394 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 229.10783394 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 12 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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