chempirical

Tilorone hydrochloride

C25H36Cl2N2O3CAS 27591-69-1483.47 g/mol

Open in Covalent MOL file
NOOONHClHCl
EtherKetoneTertiary amine

Properties

Molecular formula
C25H36Cl2N2O3
Molar mass
483.47 g/mol
Exact mass
482.2103 Da
Melting point
235–237 °C
logP
5.18Crippen estimate
Polar surface area
42.0 Ų
H-bond donors / acceptors
0 / 5
Rotatable bonds
12

Identifiers

CAS number
27591-69-1
SMILES
CCN(CC)CCOc1ccc2c(c1)C(=O)c1cc(OCCN(CC)CC)ccc1-2.Cl.Cl
InChIKey
BSVYJQAWONIOOU-UHFFFAOYSA-N
InChI
InChI=1S/C25H34N2O3.2ClH/c1-5-26(6-2)13-15-29-19-9-11-21-22-12-10-20(30-16-14-27(7-3)8-4)18-24(22)25(28)23(21)17-19;;/h9-12,17-18H,5-8,13-16H2,1-4H3;2*1H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

10 names
  • 9H-Fluoren-9-one, 2,7-bis[2-(diethylamino)ethoxy]-, hydrochloride (1:2)
  • Fluoren-9-one, 2,7-bis[2-(diethylamino)ethoxy]-, dihydrochloride
  • 9H-Fluoren-9-one, 2,7-bis[2-(diethylamino)ethoxy]-, dihydrochloride
  • Tilorone dihydrochloride
  • DEAE-F
  • RMI 10008DA
  • RMI 10028DA
  • Amyxin
  • NSC 143969
  • Amixinum

Work with Tilorone hydrochloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Tesmilifene98774-23-344 % similar Enclomiphene15690-57-042 % similar Adiphenine hydrochloride50-42-042 % similar Procaine hydrochloride51-05-842 % similar Clomiphene911-45-542 % similar Chloroprocaine hydrochloride3858-89-741 % similar 4-(2-Piperidinoethoxy)benzoic acid hydrochloride84449-80-940 % similar Proparacaine hydrochloride5875-06-939 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook