Chemical Properties of N-Benzyl butanoyl fentanyl

InChI

InChI=1S/C22H28N2O/c1-2-9-22(25)24(20-12-7-4-8-13-20)21-14-16-23(17-15-21)18-19-10-5-3-6-11-19/h3-8,10-13,21H,2,9,14-18H2,1H3

InChI Key

YYXPMGNUMFXSSW-UHFFFAOYSA-N

Formula

C22H28N2O

SMILES

CCCC(=O)N(c1ccccc1)C1CCN(Cc2ccccc2)CC1

Molecular Weight¹

336.47

• 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	-5.19		Crippen Calculated Property
logPoct/wat	4.484		Crippen Calculated Property
McVol	283.990	ml/mol	McGowan Calculated Property
Inp	[2749.00; 2749.00]
Inp	2749.00		NIST
Inp	2749.00		NIST

Similar Compounds

Find more compounds similar to N-Benzyl butanoyl fentanyl.

Sources

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

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