Chemical Properties of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,5-diethyl-3-methyl-5-phenyl- (CAS 55255-46-4)

InChI

InChI=1S/C15H18N2O3/c1-4-15(11-9-7-6-8-10-11)12(18)16(3)14(20)17(5-2)13(15)19/h6-10H,4-5H2,1-3H3

InChI Key

MKNZJVPKBDCKQB-UHFFFAOYSA-N

Formula

C15H18N2O3

SMILES

CCN1C(=O)N(C)C(=O)C(CC)(c2ccccc2)C1=O

Molecular Weight¹

274.31

CAS

55255-46-4

Other Names

• N-Ethylmethobarbital
• Mephobarbital perethylated

• 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	-2.22		Crippen Calculated Property
logPoct/wat	1.775		Crippen Calculated Property
McVol	212.260	ml/mol	McGowan Calculated Property
Inp	[1904.00; 1904.00]
Inp	1904.00		NIST
Inp	1904.00		NIST

Similar Compounds

Find more compounds similar to 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,5-diethyl-3-methyl-5-phenyl-.

Sources

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

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