Phenobarbital

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 1734
Total Number of Articles : 3740
PubChem 4763
Molecular Formula

C12H12N2O3

SMILES

CCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2

InChI

InChI=1S/C12H12N2O3/c1-2-12(8-6-4-3-5-7-8)9(15)13-11(17)14-10(12)16/h3-7H,2H2,1H3,(H2,13,14,15,16,17)

synonyms
  • phenobarbital
  • Phenobarbitone
  • Phenobarbitol
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Properties
Property Value
MW 232.23 g/mol
HBD 2
HBA 3
Rotatable Bond Count 2
Exact Mass 232.08479225 g/mol
Monoisotopic Mass 232.08479225 g/mol
Heavy Atom Count 17
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 339
xlogp 1.5
Topological Polar Surface Area 75.3