Dimethindene maleate

C24H28N2O4CAS 3614-69-5408.50 g/mol

Open in Covalent MOL file
NNOHOOOH
AlkeneCarboxylic acidTertiary amine

Properties

Molecular formula
C24H28N2O4
Molar mass
408.50 g/mol
Exact mass
408.2049 Da
Melting point
159–161 °C
logP
3.86Crippen estimate
Polar surface area
90.7 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
7

Hazards

Warning
Irritant (GHS07)Environmental Hazard (GHS09)

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P273, P301+P317, P330, P391, P501

Identifiers

CAS number
3614-69-5
SMILES
CC(C1=C(CCN(C)C)Cc2ccccc21)c1ccccn1.O=C(O)/C=CC(=O)O
InChIKey
SWECWXGUJQLXJF-BTJKTKAUSA-N
InChI
InChI=1S/C20H24N2.C4H4O4/c1-15(19-10-6-7-12-21-19)20-17(11-13-22(2)3)14-16-8-4-5-9-18(16)20;5-3(6)1-2-4(7)8/h4-10,12,15H,11,13-14H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

Weigh it out

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

Names and synonyms

13 names · show all
  • 1H-Indene-2-ethanamine, N,N-dimethyl-3-[1-(2-pyridinyl)ethyl]-, (2Z)-2-butenedioate (1:1)
  • Pyridine, 2-[1-[2-[2-(dimethylamino)ethyl]inden-3-yl]ethyl]-, maleate (1:1)
  • 1H-Indene-2-ethanamine, N,N-dimethyl-3-[1-(2-pyridinyl)ethyl]-, (Z)-2-butenedioate (1:1)
  • Pyridine, 2-[1-[2-(dimethylaminoethyl)inden-3-yl]ethyl]-, maleate
  • Su-6518
  • Dimethpyrindene maleate
  • 2-[1-[2-(2-Dimethylaminoethyl)inden-3-yl]ethyl]pyridine maleate
  • Forhistal maleate
  • Fenistil
  • Fenistil-retard
  • Dimethinden maleate
  • Fenostil
  • NSC 107677

Work with Dimethindene maleate

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Fumaric acid110-17-8Free acid, defined stereoisomer Maleic acid110-16-7Free acid Poly(maleic acid)26099-09-2Free acid Iron(II) fumarate141-01-5Salt, defined stereoisomer Enalapril maleate76095-16-4Salt, defined stereoisomer Pyrilamine maleate59-33-6Salt Chlorpheniramine maleate113-92-8Salt Timolol maleate26921-17-5Salt, defined stereoisomer Sodium fumarate5873-57-4Salt, defined stereoisomer Clemastine fumarate14976-57-9Salt, defined stereoisomer Calcium fumarate19855-56-2Salt, defined stereoisomer (±)-Brompheniramine maleate980-71-2Salt

Similar compounds

3-(2-Pyridinyl)-2-propenoic acid7340-22-935 % similar (±)-Pheniramine86-21-535 % similar 3-(Dimethylamino)-1-(naphthalen-1-yl)propan-1-one10320-49-733 % similar (±)-Brompheniramine86-22-632 % similar Ketotifen34580-13-732 % similar 3-Dimethylamino-1-(naphthalen-1-yl)propan-1-one hydrochloride5409-58-531 % similar Donormil562-10-731 % similar β-Dimethylaminopropiophenone hydrochloride879-72-130 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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