chempirical

Pyocyanin

C13H10N2OCAS 85-66-5210.24 g/mol

Open in Covalent MOL file
NNO

Properties

Molecular formula
C13H10N2O
Molar mass
210.24 g/mol
Exact mass
210.0793 Da
logP
2.04Crippen estimate
Polar surface area
34.9 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Identifiers

CAS number
85-66-5
SMILES
CN1C2=CC=CC=C2N=C3C1=CC=CC3=O
InChIKey
YNCMLFHHXWETLD-UHFFFAOYSA-N
InChI
InChI=1S/C13H10N2O/c1-15-10-6-3-2-5-9(10)14-13-11(15)7-4-8-12(13)16/h2-8H,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

16 names · show all
  • 5-Methylphenazin-1-one
  • Sanasin
  • Sanazin
  • 5-Methylphenazin-1(5H)-one
  • 1(5H)-Phenazinone, 5-methyl-
  • 5-Methylphenazin-5-ium-1-olate
  • 1-Hydroxy-5-methylphenazin-5-ium
  • Pyrocyanine
  • 5-Methyl-1(5H)-phenazinone
  • 5-Methyl-1,5-dihydrophenazin-1-one
  • Antibiotic 4738-B
  • Cyanomycin
  • 5-Methyl-phenazin-5-ium-1-olate
  • Phenazinium, hydroxide, inner salt
  • 5-Methyl-1-hydroxyphenazinium inner salt
  • Phenazine, 1,5-dihydro-5-methyl-1-oxo-

Work with Pyocyanin

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Methylacridone719-54-035 % similar 1-Methyl-2(1H)-quinolinone606-43-933 % similar 3-Methylbenzo[D]oxazol-2(3H)-one21892-80-833 % similar 1-Methyl-2-phenylindole3558-24-533 % similar N-Methylcarbazole1484-12-432 % similar Perinone4424-06-032 % similar 1-Ethyl-2-methyl-1H-benzimidazole5805-76-532 % similar 1-Methylbenzotriazole13351-73-032 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-(P-Aminophenyl)benzoxazole20934-81-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook