5-Pentyl-5-phenylbarbituric acid

5-pentyl-5-phenyl-1,3-diazinane-2,4,6-trione

CAS: 66843-09-2

Molecular Formula	`C15H18N2O3`
Molecular Weight	274.31 g/mol
LogP	3.1
Topological Polar Surface Area	75.3 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	5
Exact Mass	274.13174
Heavy Atoms	20
Complexity	380.0

Chemical Identifiers

CAS Number	66843-09-2
SMILES	`CCCCCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2`
InChIKey	`IXXXSPXHTGEIQP-UHFFFAOYSA-N`

📖 Product Overview

5-Pentyl-5-phenylbarbituric acid (CAS: 66843-09-2) is a chemical compound with molecular formula C15H18N2O3 and molecular weight 274.31 g/mol. Its IUPAC systematic name is 5-pentyl-5-phenyl-1,3-diazinane-2,4,6-trione. LogP 3.1 Topological Polar Surface Area 75.3 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 3 Rotatable Bonds 5 Exact Mass 274.13174 Heavy Atoms 20 Complexity 380.0 InChI Key: IXXXSPXHTGEIQP-UHFFFAOYSA-N. SMILES: CCCCCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2.

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