chempirical

Elacridar

C34H33N3O5CAS 143664-11-3563.65 g/mol

Open in Covalent MOL file
OONNHOOOHN
AmideEtherTertiary amine

Properties

Molecular formula
C34H33N3O5
Molar mass
563.65 g/mol
Exact mass
563.2420 Da
logP
5.56Crippen estimate
Polar surface area
92.9 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
8

Identifiers

CAS number
143664-11-3
SMILES
COc1cc2c(cc1OC)CN(CCc1ccc(NC(=O)c3cccc4c(=O)c5cccc(OC)c5[nH]c34)cc1)CC2
InChIKey
OSFCMRGOZNQUSW-UHFFFAOYSA-N
InChI
InChI=1S/C34H33N3O5/c1-40-28-9-5-7-26-32(28)36-31-25(33(26)38)6-4-8-27(31)34(39)35-24-12-10-21(11-13-24)14-16-37-17-15-22-18-29(41-2)30(42-3)19-23(22)20-37/h4-13,18-19H,14-17,20H2,1-3H3,(H,35,39)(H,36,38)

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Names and synonyms

6 names
  • 4-Acridinecarboxamide, N-[4-[2-(3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)ethyl]phenyl]-9,10-dihydro-5-methoxy-9-oxo-
  • N-[4-[2-(3,4-Dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)ethyl]phenyl]-9,10-dihydro-5-methoxy-9-oxo-4-acridinecarboxamide
  • GF 120918
  • GG 918
  • GW 0918
  • GF 129018

Work with Elacridar

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

Tariquidar206873-63-449 % similar 2-Hydroxy-N-(4-methoxyphenyl)-11H-benzo[A]carbazole-3-carboxamide86-19-133 % similar Donepezil120014-06-431 % similar Donepezil hydrochloride120011-70-331 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook