Chemical Properties of Tripelenamine M (hydroxy), acetylated

InChI

InChI=1S/C18H23N3O2/c1-15(22)23-17-9-7-16(8-10-17)14-21(13-12-20(2)3)18-6-4-5-11-19-18/h4-11H,12-14H2,1-3H3

InChI Key

NJISWQNABFGSMO-UHFFFAOYSA-N

Formula

C18H23N3O2

SMILES

CC(=O)Oc1ccc(CN(CCN(C)C)c2ccccn2)cc1

Molecular Weight¹

313.39

• 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.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-3.39		Crippen Calculated Property
logPoct/wat	2.575		Crippen Calculated Property
McVol	254.340	ml/mol	McGowan Calculated Property
Inp	[2390.00; 2390.00]
Inp	2390.00		NIST
Inp	2390.00		NIST

Similar Compounds

Find more compounds similar to Tripelenamine M (hydroxy), acetylated.

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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