Product Name

  • Name

    Eltrombopag

  • EINECS 610-469-9
  • CAS No. 496775-61-2
  • Density 1.33 g/cm3
  • Solubility
  • Melting Point 242-244 °C
  • Formula C25H22N4O4
  • Boiling Point 656.8 °C at 760 mmHg
  • Molecular Weight 442.47
  • Flash Point 351 °C
  • Transport Information
  • Appearance Orange to red solid
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 496775-61-2 (Eltrombopag)
  • Hazard Symbols
  • Synonyms Promacta;Revolade;3'-[2-[(2Z)-1-(3,4-Dimethylphenyl)-1,5-dihydro-3-methyl-5-oxo-4H-pyrazol-4-ylidene]hydrazinyl]-2'-hydroxy-[1,1'-biphenyl]-3-carboxylic acid;
  • PSA 114.59000
  • LogP 4.13840

Eltrombopag Specification

1. Introduction of Eltrombopag

Eltrombopag, with the systematic name of 3-[3-[(N'E)-N'-[1-(3,4-dimethylphenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]hydrazino]-2-hydroxy-phenyl]benzoic acid, is one kind of white crystalline powder, odorless, little bitter taste. It should be stored in dry and cool environment.

2. Properties of Eltrombopag

The properties of the chemical are: (1)ACD/LogP: 4.06; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.59; (4)ACD/LogD (pH 7.4): 0.75; (5)#H bond acceptors: 8; (6)#H bond donors: 3; (7)#Freely Rotating Bonds: 6; (8)Polar Surface Area: 114.59 Å2; (9)Index of Refraction: 1.666; (10)Molar Refractivity: 123.53 cm3; (11)Molar Volume: 332 cm3; (12)Polarizability: 48.97×10-24cm3; (13)Surface Tension: 52.5 dyne/cm; (14)Enthalpy of Vaporization: 101.61 kJ/mol; (15)Vapour Pressure: 3.79×10-18 mmHg at 25°C..

3. Structure Descriptors of Eltrombopag

You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)c1cccc(c1)c4cccc(N\N=C3C(\C)=N/N(c2ccc(C)c(C)c2)C3=O)c4O
(2)InChI: InChI=1/C25H22N4O4/c1-14-10-11-19(12-15(14)2)29-24(31)22(16(3)28-29)27-26-21-9-5-8-20(23(21)30)17-6-4-7-18(13-17)25(32)33/h4-13,26,30H,1-3H3,(H,32,33)/b27-22+
(3)InChIKey: XDXWLKQMMKQXPV-HPNDGRJYBX

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