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Details

Stereochemistry ACHIRAL
Molecular Formula C22H27FN4O4
Molecular Weight 430.4734
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DI(DEMETHYL)-DI(HYDROXYMETHYL)DPA-714

SMILES

CCN(CC)C(=O)Cc1c(-c2ccc(cc2)OCCF)nn3c(cc(CO)nc13)CO

InChI

InChIKey=LHPXGUQPDQIIDB-UHFFFAOYSA-N
InChI=1S/C22H27FN4O4/c1-3-26(4-2)20(30)12-19-21(15-5-7-18(8-6-15)31-10-9-23)25-27-17(14-29)11-16(13-28)24-22(19)27/h5-8,11,28-29H,3-4,9-10,12-14H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C22H27FN4O4
Molecular Weight 430.4734
Charge 0
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 Jun 26 08:59:17 UTC 2021
Edited
by admin
on Sat Jun 26 08:59:17 UTC 2021
Record UNII
19B0IPR8JA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DI(DEMETHYL)-DI(HYDROXYMETHYL)DPA-714
Common Name English
N,N-DIETHYL-2-(4-(2-FLUOROETHOXY)PHENYL)-5,7-BIS(HYDROXYMETHYL)PYRAZOLO(1,5-A)PYRIMIDINE-3-ACETAMIDE
Systematic Name English
PYRAZOLO(1,5-A)PYRIMIDINE-3-ACETAMIDE, N,N-DIETHYL-2-(4-(2-FLUOROETHOXY)PHENYL)-5,7-BIS(HYDROXYMETHYL)-
Systematic Name English
DPA-714 METABOLITE M6A
Common Name English
Code System Code Type Description
FDA UNII
19B0IPR8JA
Created by admin on Sat Jun 26 08:59:17 UTC 2021 , Edited by admin on Sat Jun 26 08:59:17 UTC 2021
PRIMARY
PUBCHEM
118753119
Created by admin on Sat Jun 26 08:59:17 UTC 2021 , Edited by admin on Sat Jun 26 08:59:17 UTC 2021
PRIMARY
CAS
1619223-86-7
Created by admin on Sat Jun 26 08:59:17 UTC 2021 , Edited by admin on Sat Jun 26 08:59:17 UTC 2021
PRIMARY
Related Record Type Details
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