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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H27N8O8PS
Molecular Weight 630.569
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ARQ-736 FREE ACID

SMILES

CN1C=CC(=N1)S(=O)(=O)N2CCC[C@H](C2)NC3=NC=CC(=N3)C4=C(N=C5OC=CN45)C6=CC(OCOP(O)(O)=O)=CC=C6

InChI

InChIKey=GBXJAPBXPROFPY-GOSISDBHSA-N
InChI=1S/C25H27N8O8PS/c1-31-11-8-21(30-31)43(37,38)32-10-3-5-18(15-32)27-24-26-9-7-20(28-24)23-22(29-25-33(23)12-13-39-25)17-4-2-6-19(14-17)40-16-41-42(34,35)36/h2,4,6-9,11-14,18H,3,5,10,15-16H2,1H3,(H,26,27,28)(H2,34,35,36)/t18-/m1/s1

HIDE SMILES / InChI

Molecular Formula C25H27N8O8PS
Molecular Weight 630.569
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 13:46:48 GMT 2023
Edited
by admin
on Sat Dec 16 13:46:48 GMT 2023
Record UNII
Q65L3M3JB8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ARQ-736 FREE ACID
Code English
METHANOL, 1-(3-(5-(2-(((3R)-1-((1-METHYL-1H-PYRAZOL-3-YL)SULFONYL)-3-PIPERIDINYL)AMINO)-4-PYRIMIDINYL)IMIDAZO(2,1-B)OXAZOL-6-YL)PHENOXY)-, 1-(DIHYDROGEN PHOSPHATE)
Systematic Name English
Code System Code Type Description
FDA UNII
Q65L3M3JB8
Created by admin on Sat Dec 16 13:46:49 GMT 2023 , Edited by admin on Sat Dec 16 13:46:49 GMT 2023
PRIMARY
CAS
1228237-47-5
Created by admin on Sat Dec 16 13:46:49 GMT 2023 , Edited by admin on Sat Dec 16 13:46:49 GMT 2023
PRIMARY
PUBCHEM
46207588
Created by admin on Sat Dec 16 13:46:49 GMT 2023 , Edited by admin on Sat Dec 16 13:46:49 GMT 2023
PRIMARY
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