Chemical Properties of 6-Benzylaminopurine, N,N'-di(acetyl)-

InChI

InChI=1S/C16H15N5O2/c1-11(22)20(8-13-6-4-3-5-7-13)16-14-15(17-9-18-16)19-10-21(14)12(2)23/h3-7,9-10H,8H2,1-2H3

InChI Key

YERBVWLAWKGISW-UHFFFAOYSA-N

Formula

C16H15N5O2

SMILES

CC(=O)N(Cc1ccccc1)c1ncnc2ncn(C(C)=O)c12

Molecular Weight¹

309.32

• 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	-4.90		Crippen Calculated Property
logPoct/wat	2.039		Crippen Calculated Property
McVol	226.660	ml/mol	McGowan Calculated Property
Inp	[2560.00; 2560.00]
Inp	2560.00		NIST
Inp	2560.00		NIST

Similar Compounds

Find more compounds similar to 6-Benzylaminopurine, N,N'-di(acetyl)-.

Sources

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

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