Diethylcarbamazine citrate

C16H29N3O8CAS 1642-54-2391.42 g/mol

Open in Covalent MOL file
NONNOHOOHOOHOHO
AlcoholCarboxylic acidTertiary amineUrea

Properties

Molecular formula
C16H29N3O8
Molar mass
391.42 g/mol
Exact mass
391.1955 Da
Melting point
141–143 °C
logP
-0.55Crippen estimate
Polar surface area
158.9 Ų
H-bond donors / acceptors
4 / 6
Rotatable bonds
7

Hazards

Danger
Acute Toxic (GHS06)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P270, P271, P284, P301+P317, P304+P340, P316, P320, P330, P403+P233, P405, P501

Identifiers

CAS number
1642-54-2
SMILES
CCN(CC)C(=O)N1CCN(C)CC1.O=C(O)CC(O)(CC(=O)O)C(=O)O
InChIKey
PGNKBEARDDELNB-UHFFFAOYSA-N
InChI
InChI=1S/C10H21N3O.C6H8O7/c1-4-12(5-2)10(14)13-8-6-11(3)7-9-13;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-9H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)

Weigh it out

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

Names and synonyms

24 names · show all
  • 1-Piperazinecarboxamide, N,N-diethyl-4-methyl-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
  • 1-Piperazinecarboxamide, N,N-diethyl-4-methyl-, citrate (1:1)
  • Caricide
  • Caritrol
  • Dicarocide
  • Diethylcarbamazine acid citrate
  • 1-Diethylcarbamoyl-4-methylpiperazine dihydrogen citrate
  • N,N-Diethyl-4-methyl-1-piperazinecarboxamide dihydrogen citrate
  • Ethodryl citrate
  • Franocide
  • Franozan
  • Ditrazine
  • Hetrazan
  • Ditrazin citrate
  • Filazine
  • 1-Methyl-4-diethylcarbamoylpiperazine citrate
  • Loxuran
  • Dirocide
  • Banocide
  • Ethylaminoazine citrate
  • Longicid
  • Dec
  • Filaribits
  • NSC 80513

Work with Diethylcarbamazine citrate

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.

2-Hydroxy-1,2,3-propanetricarboxylic acid hydrate (1:1)5949-29-1Hydrate Citric acid77-92-9Free acid Trisodium citrate68-04-2Salt Potassium citrate866-84-2Salt Calcium citrate813-94-5Salt Ammonium ferric citrate1185-57-5Salt Disodium citrate144-33-2Salt Monosodium citrate18996-35-5Salt Piperazine citrate144-29-6Salt Triammonium citrate3458-72-8Salt Aluminium citrate31142-56-0Salt Clostilbegit50-41-9Salt

Similar compounds

N,N-Diethyl-1-piperazinecarboxamide119-54-040 % similar N,N,N′,N′-Tetraethylurea1187-03-738 % similar (4-Methyl-piperazin-1-yl)-acetic acid54699-92-237 % similar (R)-(-)-Citramalic acid6236-10-836 % similar 2,2-Dimethylsuccinic acid597-43-335 % similar 3-(N-Methylpentylamino)propionic acid hydrochloride625120-81-234 % similar 1-Hydroxy-1-cyclopropanecarboxylic acid17994-25-133 % similar 2,2-Difluorobutanedioic acid665-31-632 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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