Cas no 108785-69-9 (Lorpiprazole)

Lorpiprazole structure
Lorpiprazole structure
Product Name:Lorpiprazole
CAS No:108785-69-9
MF:C21H26F3N5
MW:405.459854602814
CID:174947
PubChem ID:3045380
Update Time:2025-04-19

Lorpiprazole Chemical and Physical Properties

Names and Identifiers

    • Cyclopenta[3,4]pyrrolo[2,1-c]-1,2,4-triazole,5,5a,6,7,8,8a-hexahydro-3-[2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]-
    • Cyclopenta[3,4]pyrrolo[2,1-c]-1,2,4-triazole,5,5a,6,7,8,8a-hexahydro-3-[2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]
    • Lorpiprazole
    • Unii-0m14o7T47q
    • Lorpiprazole [inn]
    • (- )-cis-5,5a,6,7,8,8a-Hexahydro-3-(2-(4-(alpha,alpha,alpha-trifluoro-m-tolyl)-1-piperazinyl)ethyl)cyclopenta(3,4)pyrrolo(2,1-c)-s-triazole
    • 0M14O7T47Q
    • Q6681547
    • 108785-69-9
    • (+/-)-CIS-5,5A,6,7,8,8A-HEXAHYDRO-3-(2-(4-(.ALPHA.,.ALPHA.,.ALPHA.-TRIFLUORO-M-TOLYL)-1-PIPERAZINYL)ETHYL)CYCLOPENTA(3,4)PYRROLO(2,1-C)-S-TRIAZOLE
    • (+-)-cis-5,5a,6,7,8,8a-Hexahydro-3-(2-(4-(alpha,alpha,alpha-trifluoro-m-tolyl)-1-piperazinyl)ethyl)cyclopenta(3,4)pyrrolo(2,1-c)-s-triazole
    • Inchi: 1S/C21H26F3N5/c22-21(23,24)16-4-2-5-17(13-16)28-11-9-27(10-12-28)8-7-19-25-26-20-18-6-1-3-15(18)14-29(19)20/h2,4-5,13,15,18H,1,3,6-12,14H2/t15-,18-/m1/s1
    • InChI Key: BNRMWKUVWLKDQJ-CRAIPNDOSA-N
    • SMILES: FC(C1=CC=CC(=C1)N1CCN(CC1)CCC1=NN=C2[C@@H]3CCC[C@@H]3CN21)(F)F

Computed Properties

  • Exact Mass: 405.21400
  • Monoisotopic Mass: 405.21403
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 29
  • Rotatable Bond Count: 4
  • Complexity: 565
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 37.2
  • XLogP3: 3.3

Experimental Properties

  • Density: 1.42
  • Boiling Point: 556.8°Cat760mmHg
  • Flash Point: 290.6°C
  • Refractive Index: 1.659
  • PSA: 37.19000
  • LogP: 3.56180

Lorpiprazole Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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