Compound Summary


L-733,060 hydrochloride
  Compound Information
 L-733,060 hydrochloride

Compound Name:

L-733,060 hydrochloride

Compound CID:

11957600

Synonyms:

L-733,060 hydrochloride

L-733060 (hydrochloride)

NCGC00094093-01

148687-76-7

L-733,060

More...

Iupac Name:

(2S,3S)-3-[[3,5-bis(trifluoromethyl)phenyl]methoxy]-2-phenylpiperidine;hydrochloride

InChI:

InChI=1S/C20H19F6NO.ClH/c21-19(22,23)15-9-13(10-16(11-15)20(24,25)26)12-28-17-7-4-8-27-18(17)14-5-2-1-3-6-14;/h1-3,5-6,9-11,17-18,27H,4,7-8,12H2;1H/t17-,18-;/m0./s1

InChIKey:

DYEUTIUITGHIEO-APTPAJQOSA-N

Canonical Smiles:

C1CC(C(NC1)C2=CC=CC=C2)OCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F.Cl

Isomeric Smiles:

C1C[C@@H]([C@@H](NC1)C2=CC=CC=C2)OCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F.Cl

Molecular Weight:

439.8

Molecular Formula:

C20H20ClF6NO

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 L-733,060 hydrochloride

Molecular Weight:

439.8

Molecular Formula:

C20H20ClF6NO

Hydrogen Bond Donor Count:

2

Hydrogen Bond Acceptor Count:

8

Rotatable Bond Count:

4

Heavy Atom Count:

29

Complexity:

466

  Synonyms
 L-733,060 hydrochloride

L-733,060 hydrochloride L-733,060 hydrochloride

L-733,060 hydrochloride

L-733060 (hydrochloride)

NCGC00094093-01

148687-76-7

L-733,060

(2S,3S)-3-3,5-BIS(TRIFLUOROMETHYL)PHENYLMETHOXY-2-PHENYLPIPERIDINE HYDROCHLORIDE

3-(3,5-BIS(TRIFLUOROMETHYL)PHENYLMETHOXY)-2-PHENYL-PIPERIDINE HYDROCHLORIDE

EU-0100752

SCHEMBL4297874

CHEMBL1256740

HMS3412M11

HMS3676M11

HY-14406A

AKOS024456415

CS-0021289

L-137

SR-01000075974

SR-01000597889

SR-01000075974-1

SR-01000597889-1

(+)-cis-3((3,5- Bis(trifluoromethyl)phenyl)methyloxy)-2-phenylpiperidine hydrochloride salt

(2S,3S) 3-(3,5-Bis(trifluoromethyl)phenylmethoxy)-2-phenylpiperidine hydrochloride

(2s,3s)-3-3,5-bis(trifluoromethyl)phenyl-methoxy-2-phenyl-piperidine hydrochloride

  Experimental Data
 L-733,060 hydrochloride

Species Dose Unit Control(Avg days) Treatment(Avg days) Avg/Med Lifespan Change(%) Control(Max days) Treatment(Max days) Max Lifespan Change(%) Significant Strain Gender PubMed Avg/Med Lifespan Change tab
Caenorhabditis elegans 33.000000000000000 umol/L -39.000000000000000 NS N2 24134630 Inactive
  Experimental Data Visualization
 L-733,060 hydrochloride

  Statistics Data
 L-733,060 hydrochloride

Species Avg/Med Lifespan Change(%) Max Lifespan Change(%) Count Reference Count Data point
Caenorhabditis elegans -39.000000000000000 1 1
  Statistics Data Visualization
 L-733,060 hydrochloride