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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H30ClNO4
Molecular Weight 395.92
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of UK-447841

SMILES

COCC[C@H](CC1(CCCC1)C(=O)NCCCC2=CC=C(Cl)C=C2)C(O)=O

InChI

InChIKey=UOGBJRPKRSUJRU-QGZVFWFLSA-N
InChI=1S/C21H30ClNO4/c1-27-14-10-17(19(24)25)15-21(11-2-3-12-21)20(26)23-13-4-5-16-6-8-18(22)9-7-16/h6-9,17H,2-5,10-15H2,1H3,(H,23,26)(H,24,25)/t17-/m1/s1

HIDE SMILES / InChI

Molecular Formula C21H30ClNO4
Molecular Weight 395.92
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 11:18:26 GMT 2023
Edited
by admin
on Sat Dec 16 11:18:26 GMT 2023
Record UNII
T76DLY464G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
UK-447841
Code English
(2S)-2-((1-(3-(4-CHLOROPHENYL)PROPYLCARBAMOYL)CYCLOPENTYL)METHYL)-4-METHOXY-BUTANOIC ACID
Systematic Name English
UK447841
Code English
(.ALPHA.S)-1-(((3-(4-CHLOROPHENYL)PROPYL)AMINO)CARBONYL)-.ALPHA.-(2-METHOXYETHYL)CYCLOPENTANEPROPANOIC ACID
Systematic Name English
CYCLOPENTANEPROPANOIC ACID, 1-(((3-(4-CHLOROPHENYL)PROPYL)AMINO)CARBONYL)-.ALPHA.-(2-METHOXYETHYL)-, (.ALPHA.S)-
Systematic Name English
(S)-2-((1-((3-(4-CHLOROPHENYL)PROPYL)CARBAMOYL)CYCLOPENTYL)METHYL)-4-METHOXYBUTANOIC ACID
Systematic Name English
Code System Code Type Description
PUBCHEM
15978653
Created by admin on Sat Dec 16 11:18:26 GMT 2023 , Edited by admin on Sat Dec 16 11:18:26 GMT 2023
PRIMARY
FDA UNII
T76DLY464G
Created by admin on Sat Dec 16 11:18:26 GMT 2023 , Edited by admin on Sat Dec 16 11:18:26 GMT 2023
PRIMARY
CAS
465528-01-2
Created by admin on Sat Dec 16 11:18:26 GMT 2023 , Edited by admin on Sat Dec 16 11:18:26 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY
Mechanism of Action: Neprilysin inhibitor; Highest Development Phase: Discontinued for Female sexual dysfunction; Most Recent Events: 01 Jan 2008 Discontinued - Phase-II for Female sexual dysfunction in Sweden (PO), 02 Aug 2004 Phase-II clinical trials in Female sexual dysfunction in Sweden (PO)
ACTIVE MOIETY
In one embodiment, the invention pertains to method of the invention wherein the NEP inhibitor is UK-447841 , or a compound of the PCT application WO 2002/079143, which is herein incorporated by reference, or a pharmaceutically acceptable salt thereof. UK- 447841 is an NEP inhibitor of the following formula.(synthesis of the structure given)