Ketanserin tartrate | CAS No. 83846-83-7

Ketanserin tartrate

Basic Information

CAS Number

83846-83-7

Molecular Formula

C26H28FN3O9

Molecular Weight

545.52 g/mol

AD

Basic Physical Properties

Physical State

No data available

Melting Point

163-168°C

Boiling Point

No data available

Flash Point

No data available

Solubility

ethanol: 3.3mg/mL

Vapor Pressure

No data available

C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCN3C(=O)C4=CC=CC=C4NC3=O.C(C(C(=O)O)O)(C(=O)O)O

InChI

InChI=1S/C22H22FN3O3.C4H6O6/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29;5-1(3(7)8)2(6)4(9)10/h1-8,16H,9-14H2,(H,24,29);1-2,5-6H,(H,7,8)(H,9,10)

InChIKey

KMTLTEVOQLMYRS-UHFFFAOYSA-N

LogP

0.3012000000000004

Topological Polar Surface Area

190.23 Ų

Hydrogen Bond Donor/Acceptor

5 / 12

Complexity

761

Safety Information

View Safety Information

GHS Hazard Pictograms

H301H301

Hazard Statement

H301 Toxic if swallowed
Acute toxicity, oral

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

  • 83846-83-7
  • MLS001333708
  • SR-01000002994-4
  • NCGC00261876-01
  • R 41 468
  • Prestwick1_000392
  • HMS3267A11
  • SR-01000002994
  • LP01191
  • S-006
  • HMS3678H09
  • LS-15143
  • SCHEMBL362930
  • MLS000069367
  • 2,3-dihydroxybutanedioic acid;3-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-1H-quinazoline-2,4-dione
  • NCGC00094444-01
  • SMR000058867
  • SPBio_002524
  • 3-(2-(4-(p-Fluorobenzoyl)-1-piperidinyl)ethyl)-2,4(1H,3H)-quinazolinedione L-tartrate
  • AMY42112
  • CCG-222495
  • BK164598
  • Prestwick2_000392
  • SR-01000002994-2
  • 3-[2-[4-(4-Fluorobenzoyl)-1-piperidinyl]ethyl]-2,4[1H,3H]-quinazolinedione tartrate
  • KETANSERINTARTRATE
  • Lopac0_001191
  • HB1641
  • NCGC00016200-02
  • AKOS024458689
  • CHEMBL1256709

MDL Number

MFCD00084651

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