Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H22N6O.ClH |
| Molecular Weight | 422.911 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.NC1=C2C(=NC=N1)N(N=C2C3=CC=C(OC4=CC=CC=C4)C=C3)[C@H]5CCCNC5
InChI
InChIKey=ATLAMSZMAHXMSQ-NTISSMGPSA-N
InChI=1S/C22H22N6O.ClH/c23-21-19-20(15-8-10-18(11-9-15)29-17-6-2-1-3-7-17)27-28(22(19)26-14-25-21)16-5-4-12-24-13-16;/h1-3,6-11,14,16,24H,4-5,12-13H2,(H2,23,25,26);1H/t16-;/m0./s1
| Molecular Formula | C22H22N6O |
| Molecular Weight | 386.4497 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| 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
Edited
Wed Apr 02 19:28:23 GMT 2025
by
admin
on
Wed Apr 02 19:28:23 GMT 2025
|
| Record UNII |
3LNP44AVW9
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
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Preferred Name | English | ||
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127255897
Created by
admin on Wed Apr 02 19:28:23 GMT 2025 , Edited by admin on Wed Apr 02 19:28:23 GMT 2025
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PRIMARY | |||
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3LNP44AVW9
Created by
admin on Wed Apr 02 19:28:23 GMT 2025 , Edited by admin on Wed Apr 02 19:28:23 GMT 2025
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1642571-07-0
Created by
admin on Wed Apr 02 19:28:23 GMT 2025 , Edited by admin on Wed Apr 02 19:28:23 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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RACEMATE -> ENANTIOMER |
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![Structure of 3-(4-phenoxyphenyl)-1-[(3r)-piperidin-3-yl]-1h-pyrazolo[3,4-d]pyrimidin-4-amine hydrochloride, (R/S)-](/img/de526664-57ce-4288-a5e4-1ff5082a80cf.svg "Structure of 3-(4-phenoxyphenyl)-1-[(3r)-piperidin-3-yl]-1h-pyrazolo[3,4-d]pyrimidin-4-amine hydrochloride, (R/S)-")