Loxapine succinate

C22H24ClN3O5CAS 27833-64-3445.90 g/mol

Open in Covalent MOL file
NNNOClOHOOOH
AmidineAryl halideCarboxylic acidEtherTertiary amine

Properties

Molecular formula
C22H24ClN3O5
Molar mass
445.90 g/mol
Exact mass
445.1404 Da
logP
3.71Crippen estimate
Polar surface area
102.7 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
3

Hazards

Danger
Acute Toxic (GHS06)Irritant (GHS07)

Aggregated from 7 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P405, P501

Identifiers

CAS number
27833-64-3
SMILES
CN1CCN(C2=Nc3ccccc3Oc3ccc(Cl)cc32)CC1.O=C(O)CCC(=O)O
InChIKey
YQZBAXDVDZTKEQ-UHFFFAOYSA-N
InChI
InChI=1S/C18H18ClN3O.C4H6O4/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18;5-3(6)1-2-4(7)8/h2-7,12H,8-11H2,1H3;1-2H2,(H,5,6)(H,7,8)

Weigh it out

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

Names and synonyms

9 names
  • Butanedioic acid, compd. with 2-chloro-11-(4-methyl-1-piperazinyl)dibenz[b,f][1,4]oxazepine (1:1)
  • Succinic acid, compd. with 2-chloro-11-(4-methyl-1-piperazinyl)dibenz[b,f][1,4]oxazepine (1:1)
  • Dibenz[b,f][1,4]oxazepine, 2-chloro-11-(4-methyl-1-piperazinyl)-, butanedioate (1:1)
  • CL 71563
  • 2-Chloro-11-(4-methyl-1-piperazinyl)-dibenz[b,f][1,4]oxazepine succinate
  • Loxapac
  • Loxitane
  • Loxitane capsules
  • Daxolin

Work with Loxapine succinate

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.

Succinic acid110-15-6Free acid 1-(2-Hydroxyethyl)-2,2,6,6-tetramethyl-4-hydroxypiperidine-succinic acid copolymer70198-29-7Salt Donormil562-10-7Salt Sumatriptan succinate103628-48-4Salt Metoprolol succinate98418-47-4Salt Diammonium succinate2226-88-2Salt Disodium succinate150-90-3Salt Mexidol127464-43-1Salt Solifenacin succinate242478-38-2Salt 1,1-Dimethylethyl N-[(1S,3S,4S)-4-amino-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl]carbamate butanedioate (2:1)183388-64-9Salt Lasmiditan succinate439239-92-6Salt Sodium succinate hexahydrate6106-21-4Salt

Similar compounds

Amoxapine14028-44-566 % similar 2-Chlorodibenz[b,f][1,4]oxazepin-11(10H)-one3158-91-650 % similar Clozapine5786-21-049 % similar Asenapine maleate85650-56-240 % similar Olanzapine132539-06-138 % similar MCPB94-81-538 % similar N-Desmethylclozapine6104-71-838 % similar Asenapine65576-45-637 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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