Vodobatinib
2-chloro-6-methyl-N'-[4-methyl-3-(2-quinolin-3-ylethynyl)benzoyl]benzohydrazide
Molecular Identity
Vodobatinib
2-chloro-6-methyl-N'-[4-methyl-3-(2-quinolin-3-ylethynyl)benzoyl]benzohydrazide
PubChem CID: 89884852
2D Structure
Properties
C27H20ClN3O2
Molecular Formula
453.90
Molecular Weight
g/mol
453.1244
Exact Mass
Da
6
XLogP
Above Lipinski threshold
71.1
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
3
H-Bond Acceptors
774
Complexity
SMILES
Canonical SMILES
SMILES: CC1=C(C(=CC=C1)Cl)C(=O)NNC(=O)C2=CC(=C(C=C2)C)C#CC3=CC4=CC=CC=C4N=C3Isomeric SMILES
SMILES: CC1=C(C(=CC=C1)Cl)C(=O)NNC(=O)C2=CC(=C(C=C2)C)C#CC3=CC4=CC=CC=C4N=C3Synonyms(20)
VodobatinibSCO-088Vodobatinib [USAN]K0706K-0706N8Q12KU2SWVODOBATINIB [WHO-DD]2-chloro-6-methyl-N'-[4-methyl-3-(2-quinolin-3-ylethynyl)benzoyl]benzohydrazideVodobatinib (USAN)VODOBATINIB [INN]UNII-N8Q12KU2SWSUNK706SCO088SUN-K706WHO 11506
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Vodobatinib
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