Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C27H34N6O4S |
| Molecular Weight | 538.662 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CN=C(NC2=CC=C(OCCN3CCCC3=O)C=C2)N=C1NC4=CC=CC(=C4)S(=O)(=O)NC(C)(C)C
InChI
InChIKey=XLQXEWCBQCBYLI-UHFFFAOYSA-N
InChI=1S/C27H34N6O4S/c1-19-18-28-26(30-20-10-12-22(13-11-20)37-16-15-33-14-6-9-24(33)34)31-25(19)29-21-7-5-8-23(17-21)38(35,36)32-27(2,3)4/h5,7-8,10-13,17-18,32H,6,9,14-16H2,1-4H3,(H2,28,29,30,31)
| Molecular Formula | C27H34N6O4S |
| Molecular Weight | 538.662 |
| 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 15:25:01 GMT 2025
by
admin
on
Wed Apr 02 15:25:01 GMT 2025
|
| Record UNII |
HXM94Z3QTY
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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Preferred Name | English | ||
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Code | English |
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53418108
Created by
admin on Wed Apr 02 15:25:01 GMT 2025 , Edited by admin on Wed Apr 02 15:25:01 GMT 2025
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DTXSID90697387
Created by
admin on Wed Apr 02 15:25:01 GMT 2025 , Edited by admin on Wed Apr 02 15:25:01 GMT 2025
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HXM94Z3QTY
Created by
admin on Wed Apr 02 15:25:01 GMT 2025 , Edited by admin on Wed Apr 02 15:25:01 GMT 2025
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1245642-94-7
Created by
admin on Wed Apr 02 15:25:01 GMT 2025 , Edited by admin on Wed Apr 02 15:25:01 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE LESS ACTIVE |
2 fold less active than parent. accounting for ~ 9% of the radioactivity AUC.
MAJOR
PLASMA
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