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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H27O7S2.K
Molecular Weight 554.717
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AZD-4619 POTASSIUM

SMILES

[K+].CS(=O)(=O)OC1=CC=C(OCCC2=CC=C(C[C@H](SCCC3=CC=C(O)C=C3)C([O-])=O)C=C2)C=C1

InChI

InChIKey=JWMOTVDQJQHMNX-UQIIZPHYSA-M
InChI=1S/C26H28O7S2.K/c1-35(30,31)33-24-12-10-23(11-13-24)32-16-14-19-2-4-21(5-3-19)18-25(26(28)29)34-17-15-20-6-8-22(27)9-7-20;/h2-13,25,27H,14-18H2,1H3,(H,28,29);/q;+1/p-1/t25-;/m0./s1

HIDE SMILES / InChI

Molecular Formula K
Molecular Weight 39.0983
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C26H27O7S2
Molecular Weight 515.618
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:25:46 GMT 2023
Edited
by admin
on Fri Dec 15 15:25:46 GMT 2023
Record UNII
KZ4K1242VB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AZD-4619 POTASSIUM
Common Name English
BENZENEPROPANOIC ACID, .ALPHA.-((2-(4-HYDROXYPHENYL)ETHYL)THIO)-4-(2-(4-((METHYLSULFONYL)OXY)PHENOXY)ETHYL)-, POTASSIUM SALT, (-)-
Common Name English
POTASSIUM (S)-2-((4-HYDROXYPHENETHYL)THIO)-3-(4-(2-(4-((METHYLSULFONYL)OXY)PHENOXY)ETHYL)PHENYL)PROPANOATE
Systematic Name English
BENZENEPROPANOIC ACID, .ALPHA.-((2-(4-HYDROXYPHENYL)ETHYL)THIO)-4-(2-(4-((METHYLSULFONYL)OXY)PHENOXY)ETHYL)-, POTASSIUM SALT, (.ALPHA.S)-
Common Name English
Code System Code Type Description
FDA UNII
KZ4K1242VB
Created by admin on Fri Dec 15 15:25:46 GMT 2023 , Edited by admin on Fri Dec 15 15:25:46 GMT 2023
PRIMARY
CAS
815608-41-4
Created by admin on Fri Dec 15 15:25:46 GMT 2023 , Edited by admin on Fri Dec 15 15:25:46 GMT 2023
PRIMARY
PUBCHEM
72941917
Created by admin on Fri Dec 15 15:25:46 GMT 2023 , Edited by admin on Fri Dec 15 15:25:46 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY