U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C21H25F3N6O2
Molecular Weight 450.4574
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LENIOLISIB

SMILES

CCC(=O)N1CC[C@@H](C1)NC2=C3CN(CCC3=NC=N2)C4=CN=C(OC)C(=C4)C(F)(F)F

InChI

InChIKey=MWKYMZXCGYXLPL-ZDUSSCGKSA-N
InChI=1S/C21H25F3N6O2/c1-3-18(31)30-6-4-13(10-30)28-19-15-11-29(7-5-17(15)26-12-27-19)14-8-16(21(22,23)24)20(32-2)25-9-14/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,26,27,28)/t13-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H25F3N6O2
Molecular Weight 450.4574
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:27:20 GMT 2023
Edited
by admin
on Sat Dec 16 05:27:20 GMT 2023
Record UNII
L22772Z9CP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LENIOLISIB
INN  
USAN   INN  
Official Name English
LENIOLISIB [USAN]
Common Name English
CDZ173 FREE BASE
Common Name English
CDZ-173-NX
Code English
CDZ173-NX
Code English
Leniolisib [WHO-DD]
Common Name English
1-((3S)-3-((6-(6-METHOXY-5-(TRIFLUOROMETHYL)PYRIMIDIN-3-YL)-5,6,7,8-TETRAHYDROPYRIDO(4,3-D)PYRIMIDIN-4-YL)AMINO)PYRROLIDIN-1-YL)PROPAN-1-ONE
Common Name English
leniolisib [INN]
Common Name English
1-PROPANONE, 1-((3S)-3-((5,6,7,8-TETRAHYDRO-6-(6-METHOXY-5-(TRIFLUOROMETHYL)-3-PYRIDINYL)PYRIDO(4,3-D)PYRIMIDIN-4-YL)AMINO)-1-PYRROLIDINYL)-
Systematic Name English
CDZ-173 FREE BASE
Common Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 504315
Created by admin on Sat Dec 16 05:27:21 GMT 2023 , Edited by admin on Sat Dec 16 05:27:21 GMT 2023
Code System Code Type Description
SMS_ID
100000174634
Created by admin on Sat Dec 16 05:27:21 GMT 2023 , Edited by admin on Sat Dec 16 05:27:21 GMT 2023
PRIMARY
CAS
1354690-24-6
Created by admin on Sat Dec 16 05:27:21 GMT 2023 , Edited by admin on Sat Dec 16 05:27:21 GMT 2023
PRIMARY
FDA UNII
L22772Z9CP
Created by admin on Sat Dec 16 05:27:21 GMT 2023 , Edited by admin on Sat Dec 16 05:27:21 GMT 2023
PRIMARY
PUBCHEM
57495353
Created by admin on Sat Dec 16 05:27:21 GMT 2023 , Edited by admin on Sat Dec 16 05:27:21 GMT 2023
PRIMARY
USAN
EF-08
Created by admin on Sat Dec 16 05:27:21 GMT 2023 , Edited by admin on Sat Dec 16 05:27:21 GMT 2023
PRIMARY
DAILYMED
L22772Z9CP
Created by admin on Sat Dec 16 05:27:21 GMT 2023 , Edited by admin on Sat Dec 16 05:27:21 GMT 2023
PRIMARY
INN
10255
Created by admin on Sat Dec 16 05:27:21 GMT 2023 , Edited by admin on Sat Dec 16 05:27:21 GMT 2023
PRIMARY
NCI_THESAURUS
C170103
Created by admin on Sat Dec 16 05:27:21 GMT 2023 , Edited by admin on Sat Dec 16 05:27:21 GMT 2023
PRIMARY
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SALT/SOLVATE -> PARENT
TARGET -> INHIBITOR
IC50
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ACTIVE MOIETY