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Details

Stereochemistry ABSOLUTE
Molecular Formula C29H28ClF3N6O4
Molecular Weight 617.019
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of FK-330

SMILES

FC(F)(F)C1=CC(OC2CCN(CC2)C(=O)CNC(=O)[C@H](CC3=NC=CC=C3)NC(=O)\C=C\C4=CC=C(Cl)C=C4)=NC=N1

InChI

InChIKey=MVJHAYBYNRTWJF-CJHOVAGGSA-N
InChI=1S/C29H28ClF3N6O4/c30-20-7-4-19(5-8-20)6-9-25(40)38-23(15-21-3-1-2-12-34-21)28(42)35-17-27(41)39-13-10-22(11-14-39)43-26-16-24(29(31,32)33)36-18-37-26/h1-9,12,16,18,22-23H,10-11,13-15,17H2,(H,35,42)(H,38,40)/b9-6+/t23-/m0/s1

HIDE SMILES / InChI

Molecular Formula C29H28ClF3N6O4
Molecular Weight 617.019
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 07:58:21 GMT 2023
Edited
by admin
on Sat Dec 16 07:58:21 GMT 2023
Record UNII
K47C68D94B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FK-330
Common Name English
2-PYRIDINEPROPANAMIDE, .ALPHA.-(((2E)-3-(4-CHLOROPHENYL)-1-OXO-2-PROPEN-1-YL)AMINO)-N-(2-OXO-2-(4-((6-(TRIFLUOROMETHYL)-4-PYRIMIDINYL)OXY)-1-PIPERIDINYL)ETHYL)-, (.ALPHA.S)-
Systematic Name English
ASP 9853 [WHO-DD]
Common Name English
FR-260330
Code English
Classification Tree Code System Code
NCI_THESAURUS C274
Created by admin on Sat Dec 16 07:58:21 GMT 2023 , Edited by admin on Sat Dec 16 07:58:21 GMT 2023
Code System Code Type Description
FDA UNII
K47C68D94B
Created by admin on Sat Dec 16 07:58:21 GMT 2023 , Edited by admin on Sat Dec 16 07:58:21 GMT 2023
PRIMARY
PUBCHEM
11308045
Created by admin on Sat Dec 16 07:58:21 GMT 2023 , Edited by admin on Sat Dec 16 07:58:21 GMT 2023
PRIMARY
NCI_THESAURUS
C116728
Created by admin on Sat Dec 16 07:58:21 GMT 2023 , Edited by admin on Sat Dec 16 07:58:21 GMT 2023
PRIMARY NCIT
CAS
442198-67-6
Created by admin on Sat Dec 16 07:58:21 GMT 2023 , Edited by admin on Sat Dec 16 07:58:21 GMT 2023
PRIMARY
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SALT/SOLVATE -> PARENT
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