Chemical Properties of Meclizine

InChI

InChI=1S/C25H27ClN2/c1-20-6-5-7-21(18-20)19-27-14-16-28(17-15-27)25(22-8-3-2-4-9-22)23-10-12-24(26)13-11-23/h2-13,18,25H,14-17,19H2,1H3

InChI Key

OCJYIGYOJCODJL-UHFFFAOYSA-N

Formula

C25H27ClN2

SMILES

Cc1cccc(CN2CCN(C(c3ccccc3)c3ccc(Cl)cc3)CC2)c1

Molecular Weight¹

390.96

Other Names

• (.+/-.)-Meclizine
• 1-(p-Chloro-«alpha»-phenylbenzyl)-4-(m-methylbenzyl)piperazine
• 1-(p-Chlorobenzhydryl)-4-(m-methylbenzyl)diethylenediamine
• 1-(p-Chlorobenzhydryl)-4-(m-methylbenzyl)piperazine
• 1-[(4-chlorophenyl)-phenylmethyl]-4-[(3-methylphenyl)methyl]piperazine
• Ancolan
• Ancolon
• Antivert
• Bonadettes
• Bonine
• Calmonal
• Chiclida
• Histamethine
• Histamethizine
• Histametizine
• Histametizyne
• Itinerol
• Marex
• Meclozine
• Monamine
• NSC 169189
• Navicalm
• Neo-Istafene
• Parachloramine
• Peremesin
• Piperazine, 1-(p-chloro-alpha-phenylbenzyl)-4-(m-methylbenzyl)-
• Piperazine, 1-(p-chloro-«alpha»-phenylbenzyl)-4-(m-methylbenzyl)-
• Piperazine, 1-[(4-chlorophenyl)phenylmethyl]-4-[(3-methylphenyl)methyl]-
• Postafen
• Postafene
• Ravelon
• Sabari
• Sea-Legs
• Siguran
• Suprimal
• Travelon
• U. C. B. 5062
• UCB 5052
• UCB 5062
• Vibazine
• Vomisseis
• Vomissels
• neo-Suprimal
• neo-Suprimel

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-4.63		Aq. Solubility Prediction
logPoct/wat	5.556		Crippen Calculated Property
McVol	313.170	ml/mol	McGowan Calculated Property
Inp	[3000.00; 3050.00]
Inp	3040.00		NIST
Inp	3034.00		NIST
Inp	3030.00		NIST
Inp	3050.00		NIST
Inp	3030.00		NIST
Inp	3030.00		NIST
Inp	Outlier 3000.00		NIST
Inp	3040.00		NIST
Inp	3040.00		NIST
Inp	3035.00		NIST
Inp	3033.00		NIST
Inp	3050.00		NIST
Inp	3040.00		NIST
Inp	3033.00		NIST
Tfus	356.24	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Find more compounds similar to Meclizine.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Aqueous Solubility Prediction Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.
These property values are available through the Cheméo API. A free account gives you an access key.