Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C27H26F2N8O3 |
| Molecular Weight | 548.5439 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC=C2N=CN=C(NC3=CC=C(OC4=CC5=NC=NN5C=N4)C(C)=C3)C2=C1O[C@@H]6CCN(C)CC6(F)F
InChI
InChIKey=PTKRHBXNNDLRPO-OAQYLSRUSA-N
InChI=1S/C27H26F2N8O3/c1-16-10-17(4-6-19(16)39-23-11-22-31-14-34-37(22)15-33-23)35-26-24-18(30-13-32-26)5-7-20(38-3)25(24)40-21-8-9-36(2)12-27(21,28)29/h4-7,10-11,13-15,21H,8-9,12H2,1-3H3,(H,30,32,35)/t21-/m1/s1
| Molecular Formula | C27H26F2N8O3 |
| Molecular Weight | 548.5439 |
| 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
Edited
Wed Apr 02 06:18:00 GMT 2025
by
admin
on
Wed Apr 02 06:18:00 GMT 2025
|
| Record UNII |
UN8TM5120C
|
| 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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Official Name | English | ||
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Systematic Name | English | ||
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Systematic Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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2414056-31-6
Created by
admin on Wed Apr 02 06:18:00 GMT 2025 , Edited by admin on Wed Apr 02 06:18:00 GMT 2025
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146448634
Created by
admin on Wed Apr 02 06:18:00 GMT 2025 , Edited by admin on Wed Apr 02 06:18:00 GMT 2025
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13444
Created by
admin on Wed Apr 02 06:18:00 GMT 2025 , Edited by admin on Wed Apr 02 06:18:00 GMT 2025
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UN8TM5120C
Created by
admin on Wed Apr 02 06:18:00 GMT 2025 , Edited by admin on Wed Apr 02 06:18:00 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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SALT/SOLVATE -> PARENT |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
epidermal growth factor receptor tyrosine kinase inhibitor
|