chempirical

16,23-Dihydronaphth[2′,3′:6,7]indolo[2,3-C]dinaphtho[2,3-A:2′,3′-I]carbazole-5,10,15,17,22,24-hexone

C42H18N2O6CAS 2475-33-4646.61 g/mol

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Properties

Molecular formula
C42H18N2O6
Molar mass
646.61 g/mol
Exact mass
646.1165 Da
logP
6.35Crippen estimate
Polar surface area
134.0 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
0

Identifiers

CAS number
2475-33-4
SMILES
O=c1c2ccccc2c(=O)c2c1ccc1c2[nH]c2c3c(=O)c4ccccc4c(=O)c3c3[nH]c4c(ccc5c(=O)c6ccccc6c(=O)c54)c3c12
InChIKey
DCYIADGZPJOOFN-UHFFFAOYSA-N
InChI
InChI=1S/C42H18N2O6/c45-37-17-7-1-3-9-19(17)39(47)29-25(37)15-13-23-27-28-24-14-16-26-30(40(48)20-10-4-2-8-18(20)38(26)46)34(24)44-36(28)32-31(35(27)43-33(23)29)41(49)21-11-5-6-12-22(21)42(32)50/h1-16,43-44H

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Names and synonyms

40 names · show all
  • Naphth[2′,3′:6,7]indolo[2,3-c]dinaphtho[2,3-a:2′,3′-i]carbazole-5,10,15,17,22,24-hexone, 16,23-dihydro-
  • Dinaphtho[2,3-a:2′,3′-i]naphth[2′,3′:6,7]indolo[2,3-c]carbazole-5,10,15,17,22,24-hexone, 16,23-dihydro-
  • C.I. 70800
  • Ahcovat brown BR
  • Amanthrene brown BR
  • Benzadone brown BR
  • Brown SK
  • Calcoloid brown BR
  • Caledon dark brown 3R
  • Carbanthrene brown BR
  • Chemithrene brown BR
  • Cibanone brown BR
  • Cibanone brown FBR
  • C.I. Vat brown 1
  • Fenanthren brown BR
  • Indanthren bronze BR
  • Indanthren brown BR
  • Indanthrene brown BR
  • Mayvat brown BR
  • Mikethrene brown BR
  • Nihonthrene brown BR
  • Nyanthrene brown RB
  • Ostanthren brown BR
  • Palanthrene brown BR
  • Paradone red brown 2RD
  • Ponsol brown RBT
  • Romantrene brown FBR
  • Romantrene brown FGR
  • Sandothrene brown NBR
  • Solanthrene brown BR
  • Solanthrene brown JR
  • Tinon brown BR
  • Tyrian brown I-BR
  • Vat brown SK
  • Solanthrene brown F-BR
  • Vat brown SKD
  • Novatic brown BR
  • Vat brown BR
  • Vat brown 1
  • Navinon brown BR

Work with 16,23-Dihydronaphth[2′,3′:6,7]indolo[2,3-C]dinaphtho[2,3-A:2′,3′-I]carbazole-5,10,15,17,22,24-hexone

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

Indanthrone blue81-77-666 % similar Blue K130-20-154 % similar Solvent orange 6316294-75-040 % similar Vat green 33271-76-938 % similar Dibenzo[A,D]cyclohepten-5-one2222-33-538 % similar Thioxanthone492-22-835 % similar N-Methylacridone719-54-032 % similar Benzo[A]carbazole239-01-032 % similar

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

Elsewhere

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