Chemical Properties of claritine

InChI

InChI=1S/C22H23ClN2O2/c1-2-27-22(26)25-12-9-15(10-13-25)20-19-8-7-18(23)14-17(19)6-5-16-4-3-11-24-21(16)20/h3-4,7-8,11,14H,2,5-6,9-10,12-13H2,1H3

InChI Key

JCCNYMKQOSZNPW-UHFFFAOYSA-N

Formula

C22H23ClN2O2

SMILES

CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1

Molecular Weight¹

382.89

Other Names

• ethyl 4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)-1-piperidinecarboxylate
• loratadine

• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	24.48	kJ/mol	Thermal...
log10WS	-6.36		Crippen Calculated Property
logPoct/wat	4.888		Crippen Calculated Property
McVol	286.940	ml/mol	McGowan Calculated Property
Tfus	407.00	K	Solubil...
Ttriple	[305.40; 410.00]	K
Ttriple	305.40	K	Thermal...
Ttriple	410.00	K	Thermal...

Similar Compounds

Find more compounds similar to claritine.

Sources

• Crippen Method
• Crippen Method
• Solubility measurement of an antihistamine drug (Loratadine) in supercritical carbon dioxide: Assessment of qCPA and PCP-SAFT equations of state
• Thermal behavior and dynamic fragility in amorphous carisoprodol. Correlation between the dynamic and thermodynamic fragilities
• McGowan Method

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