1218779-75-9 | Apatinib

Availability
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Description

• Catalog Number: AA54472
• Chemical Name: Apatinib
• CAS Number: 1218779-75-9
• Molecular Formula: C25H27N5O4S
• Molecular Weight: 493.578
• MDL Number: MFCD22420814
• SMILES: CS(=O)(=O)O.N#CC1(CCCC1)c1ccc(cc1)NC(=O)c1cccnc1NCc1ccncc1

Computed Properties

• Complexity: 701
• Covalently-Bonded Unit Count: 2
• Heavy Atom Count: 35
• Hydrogen Bond Acceptor Count: 8
• Hydrogen Bond Donor Count: 3
• Rotatable Bond Count: 6

Literature

• Simultaneous determination of apatinib and its four major metabolites in human plasma using liquid chromatography-tandem mass spectrometry and its application to a pharmacokinetic study.

  Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20120501

• YN968D1 is a novel and selective inhibitor of vascular endothelial growth factor receptor-2 tyrosine kinase with potent activity in vitro and in vivo.

  Cancer science 20110701

• Apatinib (YN968D1) reverses multidrug resistance by inhibiting the efflux function of multiple ATP-binding cassette transporters.

  Cancer research 20101015

• Safety and pharmacokinetics of novel selective vascular endothelial growth factor receptor-2 inhibitor YN968D1 in patients with advanced malignancies.

  BMC cancer 20100101