Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H24F2N4O2 |
| Molecular Weight | 366.4056 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@H]1CCN1C2=NC(N3CC[C@H](CCC(O)=O)C3)=C4CCC(F)(F)C4=N2
InChI
InChIKey=AIYUIFPRCKEHOE-RYUDHWBXSA-N
InChI=1S/C18H24F2N4O2/c1-11-5-9-24(11)17-21-15-13(4-7-18(15,19)20)16(22-17)23-8-6-12(10-23)2-3-14(25)26/h11-12H,2-10H2,1H3,(H,25,26)/t11-,12-/m0/s1
| Molecular Formula | C18H24F2N4O2 |
| Molecular Weight | 366.4056 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 18:19:14 GMT 2025
by
admin
on
Wed Apr 02 18:19:14 GMT 2025
|
| Record UNII |
CQT7H3C9Z6
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Preferred Name | English |
| Code System | Code | Type | Description | ||
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CQT7H3C9Z6
Created by
admin on Wed Apr 02 18:19:14 GMT 2025 , Edited by admin on Wed Apr 02 18:19:14 GMT 2025
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3034829-40-5
Created by
admin on Wed Apr 02 18:19:14 GMT 2025 , Edited by admin on Wed Apr 02 18:19:14 GMT 2025
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169450086
Created by
admin on Wed Apr 02 18:19:14 GMT 2025 , Edited by admin on Wed Apr 02 18:19:14 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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TARGET -> INHIBITOR |
IC50
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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![Structure of 3-((S)-1-(7,7-Difluoro-2-((S)-2-methylazetidin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl)propanoic acid](/img/3e2ac0ee-44bb-49b7-b264-12c300dc8746.svg "Structure of 3-((S)-1-(7,7-Difluoro-2-((S)-2-methylazetidin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl)propanoic acid")