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Details

Stereochemistry ACHIRAL
Molecular Formula C23H17ClNO3S.K
Molecular Weight 462.002
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PXL-770 ANHYDROUS

SMILES

[K+].OC1=C(C=CC2=C1CCCC2)C3=C(Cl)SC4=C3C([O-])=C(C(=O)N4)C5=CC=CC=C5

InChI

InChIKey=LWVVLKOKCHODDJ-UHFFFAOYSA-M
InChI=1S/C23H18ClNO3S.K/c24-21-17(15-11-10-12-6-4-5-9-14(12)19(15)26)18-20(27)16(13-7-2-1-3-8-13)22(28)25-23(18)29-21;/h1-3,7-8,10-11,26H,4-6,9H2,(H2,25,27,28);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C23H17ClNO3S
Molecular Weight 422.904
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:14:36 GMT 2023
Edited
by admin
on Sat Dec 16 19:14:36 GMT 2023
Record UNII
GVW5CLY72G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PXL-770 ANHYDROUS
Preferred Name English
Thieno[2,3-b]pyridin-6(7H)-one, 2-chloro-4-hydroxy-5-phenyl-3-(5,6,7,8-tetrahydro-1-hydroxy-2-naphthalenyl)-, potassium salt (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
GVW5CLY72G
Created by admin on Sat Dec 16 19:14:36 GMT 2023 , Edited by admin on Sat Dec 16 19:14:36 GMT 2023
PRIMARY
CAS
1523493-78-8
Created by admin on Sat Dec 16 19:14:36 GMT 2023 , Edited by admin on Sat Dec 16 19:14:36 GMT 2023
PRIMARY
PUBCHEM
118125592
Created by admin on Sat Dec 16 19:14:36 GMT 2023 , Edited by admin on Sat Dec 16 19:14:36 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
SOLVATE->ANHYDROUS
Related Record Type Details
ACTIVE MOIETY