chempirical

Ellipticine

C17H14N2CAS 519-23-3246.31 g/mol

Open in Covalent MOL file
NHN

Properties

Molecular formula
C17H14N2
Molar mass
246.31 g/mol
Exact mass
246.1157 Da
Melting point
313 °C
logP
4.49Crippen estimate
Polar surface area
28.7 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
519-23-3
SMILES
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12
InChIKey
CTSPAMFJBXKSOY-UHFFFAOYSA-N
InChI
InChI=1S/C17H14N2/c1-10-14-9-18-8-7-12(14)11(2)17-16(10)13-5-3-4-6-15(13)19-17/h3-9,19H,1-2H3

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Names and synonyms

4 names
  • 6H-Pyrido[4,3-b]carbazole, 5,11-dimethyl-
  • 5,11-Dimethyl-6H-pyrido[4,3-b]carbazole
  • NSC 71795
  • CP 5

Work with Ellipticine

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

Beta-carboline244-63-350 % similar Harmane486-84-044 % similar 2,3-Dimethylindole91-55-440 % similar 14H- Benzo [C] benzo [4,5] thieno [2,3-A] carbazole[1313395-18-435 % similar 9,10-Dimethylanthracene781-43-134 % similar 5-Bromo-7H-benzo[C]carbazole131409-18-233 % similar 7H-Benzo[C]carbazole205-25-433 % similar Benzo[A]carbazole239-01-033 % similar

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

Same formula

3,3'-Diindolylmethane1968-05-4

Elsewhere

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