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Details

Stereochemistry ACHIRAL
Molecular Formula C28H24FN3O5.ClH
Molecular Weight 537.967
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Cabozantinib Hydrochloride

SMILES

Cl.COC1=C(OC)C=C2C(OC3=CC=C(NC(=O)C4(CC4)C(=O)NC5=CC=C(F)C=C5)C=C3)=CC=NC2=C1

InChI

InChIKey=LCNVAOXPKXBXEH-UHFFFAOYSA-N
InChI=1S/C28H24FN3O5.ClH/c1-35-24-15-21-22(16-25(24)36-2)30-14-11-23(21)37-20-9-7-19(8-10-20)32-27(34)28(12-13-28)26(33)31-18-5-3-17(29)4-6-18;/h3-11,14-16H,12-13H2,1-2H3,(H,31,33)(H,32,34);1H

HIDE SMILES / InChI

Molecular Formula C28H24FN3O5
Molecular Weight 501.5057
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:53:49 UTC 2023
Edited
by admin
on Sat Dec 16 19:53:49 UTC 2023
Record UNII
NQ78NA4UAX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Cabozantinib Hydrochloride
Common Name English
Cabozantinib hydrochloride (1:1)
Common Name English
N'1-{4-[(6,7-dimethoxyquinolin-4-yl)oxy]phenyl}-N1-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide hydrochloride
Systematic Name English
1,1-Cyclopropanedicarboxamide, N-[4-[(6,7-dimethoxy-4-quinolinyl)oxy]phenyl]-N′-(4-fluorophenyl)-, hydrochloride (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
NQ78NA4UAX
Created by admin on Sat Dec 16 19:53:49 UTC 2023 , Edited by admin on Sat Dec 16 19:53:49 UTC 2023
PRIMARY
PUBCHEM
122573030
Created by admin on Sat Dec 16 19:53:49 UTC 2023 , Edited by admin on Sat Dec 16 19:53:49 UTC 2023
PRIMARY
CAS
1817759-42-4
Created by admin on Sat Dec 16 19:53:49 UTC 2023 , Edited by admin on Sat Dec 16 19:53:49 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY
Name Property Type Amount Referenced Substance Defining Parameters References
Biological Half-life PHARMACOKINETIC
Tmax PHARMACOKINETIC ORAL ADMINISTRATION

Volume of Distribution PHARMACOKINETIC