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Details

Stereochemistry ACHIRAL
Molecular Formula C22H25F3N4O.ClH
Molecular Weight 454.916
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TP-3654 HYDROCHLORIDE

SMILES

Cl.CC(C)(O)[C@H]1CC[C@@H](CC1)NC2=NN3C(C=C2)=NC=C3C4=CC(=CC=C4)C(F)(F)F

InChI

InChIKey=RJXWMEFBAZTYCY-BFLZMHAMSA-N
InChI=1S/C22H25F3N4O.ClH/c1-21(2,30)15-6-8-17(9-7-15)27-19-10-11-20-26-13-18(29(20)28-19)14-4-3-5-16(12-14)22(23,24)25;/h3-5,10-13,15,17,30H,6-9H2,1-2H3,(H,27,28);1H/t15-,17-;

HIDE SMILES / InChI

Molecular Formula C22H25F3N4O
Molecular Weight 418.4553
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

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

Targets

Targets

Primary TargetPharmacologyConditionPotency
5.0 nM [Ki]
42.0 nM [Ki]
Substance Class Chemical
Created
by admin
on Sat Dec 16 15:06:52 GMT 2023
Edited
by admin
on Sat Dec 16 15:06:52 GMT 2023
Record UNII
D7A0W431TR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TP-3654 HYDROCHLORIDE
Code English
SGI-9481 HYDROCHLORIDE
Code English
2-(trans-4-((3-(3-(trifluoromethyl)phenyl)imidazo[1,2-b]pyridazin6-yl)amino)cyclohexyl)propan-2-ol hydrochloride
Systematic Name English
2-(4-((3-(3-(TRIFLUOROMETHYL)PHENYL)IMIDAZO(1,2-B)PYRIDAZIN-6-YL)AMINO)CYCLOHEXYL)PROPAN-2-OL HYDROCHLORIDE
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 874922
Created by admin on Sat Dec 16 15:06:52 GMT 2023 , Edited by admin on Sat Dec 16 15:06:52 GMT 2023
Code System Code Type Description
FDA UNII
D7A0W431TR
Created by admin on Sat Dec 16 15:06:52 GMT 2023 , Edited by admin on Sat Dec 16 15:06:52 GMT 2023
PRIMARY
CAS
1418143-09-5
Created by admin on Sat Dec 16 15:06:52 GMT 2023 , Edited by admin on Sat Dec 16 15:06:52 GMT 2023
PRIMARY
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