Trimeprazine tartrate

C22H28N2O6SCAS 4330-99-8448.53 g/mol

Open in Covalent MOL file
NNSOHOOHOHOOH
AlcoholCarboxylic acidSulfideTertiary amine

Properties

Molecular formula
C22H28N2O6S
Molar mass
448.53 g/mol
Exact mass
448.1668 Da
logP
2.36Crippen estimate
Polar surface area
121.5 Ų
H-bond donors / acceptors
4 / 7
Rotatable bonds
7
Stereocentres
R, Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
4330-99-8
SMILES
CC(CN(C)C)CN1c2ccccc2Sc2ccccc21.O=C(O)[C@H](O)[C@@H](O)C(=O)O
InChIKey
ZEEPCWVFSHMOPI-LREBCSMRSA-N
InChI
InChI=1S/C18H22N2S.C4H6O6/c1-14(12-19(2)3)13-20-15-8-4-6-10-17(15)21-18-11-7-5-9-16(18)20;5-1(3(7)8)2(6)4(9)10/h4-11,14H,12-13H2,1-3H3;1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.1/s1

Weigh it out

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

Names and synonyms

13 names · show all
  • 10H-Phenothiazine-10-propanamine, N,N,β-trimethyl-, (2R,3R)-2,3-dihydroxybutanedioate (2:1)
  • Phenothiazine, 10-[3-(dimethylamino)-2-methylpropyl]-, tartrate (2:1)
  • 10H-Phenothiazine-10-propanamine, N,N,β-trimethyl-, [R-(R*,R*)]-2,3-dihydroxybutanedioate (2:1)
  • 10-(3-Dimethylamino-2-methylpropyl)phenothiazine tartrate
  • Vallergan
  • Theralene
  • Alimemazine tartrate
  • Temaril
  • Panectyl
  • Vanectyl
  • Repeltin
  • Temaril 16
  • NSC 17475

Work with Trimeprazine tartrate

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.

Tartaric acid87-69-4Free acid D-Tartaric acid147-71-7Free acid, enantiomer DL-Tartaric acid133-37-9Free acid, enantiomer 2,3-Dihydroxybutanedioic acid526-83-0Free acid, stereo not defined (±)-Trimeprazine84-96-8Free base Potassium bitartrate868-14-4Salt Sodium tartrate868-18-8Salt Potassium sodium tartrate304-59-6Salt Potassium tartrate921-53-9Salt N,N-Dimethylethanolamine bitartrate5988-51-2Salt (-)-Epinephrine (+)-bitartrate51-42-3Salt Choline bitartrate87-67-2Salt

Similar compounds

(±)-Promethazine60-87-746 % similar Promethazine hydrochloride58-33-343 % similar Mepazine hydrochloride2975-36-240 % similar Promazine hydrochloride53-60-140 % similar Acepromazine maleate3598-37-638 % similar Mequitazine29216-28-237 % similar (2R,3R)-Tartranilic acid3019-58-735 % similar 3-Amino-2-hydroxy-4-phenylbutanoic acid59554-14-235 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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