Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C40H52FN13O4 |
| Molecular Weight | 797.924 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CN1CCN([C@@H]2CCCN(C2)C3=NC(NC4=CC=C(N5CCN(CC6CCN(CC6)C7=CC=C(N8CCC(=O)NC8=O)C(C)=C7)CC5)C(F)=C4)=C(N=N3)C(N)=O)C1=O
InChI
InChIKey=QVYCTHKQEODBDL-SSEXGKCCSA-N
InChI=1S/C40H52FN13O4/c1-26-22-29(6-8-32(26)54-15-11-34(55)44-39(54)57)50-13-9-27(10-14-50)24-49-17-19-51(20-18-49)33-7-5-28(23-31(33)41)43-37-35(36(42)56)46-47-38(45-37)52-12-3-4-30(25-52)53-21-16-48(2)40(53)58/h5-8,22-23,27,30H,3-4,9-21,24-25H2,1-2H3,(H2,42,56)(H,43,45,47)(H,44,55,57)/t30-/m1/s1
| Molecular Formula | C40H52FN13O4 |
| Molecular Weight | 797.924 |
| 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 19:27:31 GMT 2025
by
admin
on
Wed Apr 02 19:27:31 GMT 2025
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| Record UNII |
XP8EBD5D8M
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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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166452635
Created by
admin on Wed Apr 02 19:27:31 GMT 2025 , Edited by admin on Wed Apr 02 19:27:31 GMT 2025
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XP8EBD5D8M
Created by
admin on Wed Apr 02 19:27:31 GMT 2025 , Edited by admin on Wed Apr 02 19:27:31 GMT 2025
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2955873-30-8
Created by
admin on Wed Apr 02 19:27:31 GMT 2025 , Edited by admin on Wed Apr 02 19:27:31 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
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ACTIVE MOIETY |
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![Structure of 5-[4-[4-[[1-[4-(2,4-dioxo-1,3-diazinan-1-yl)-3-methylphenyl]piperidin-4-yl]methyl]piperazin-1-yl]-3-fluoroanilino]-3-[(3R)-3-(3-methyl-2-oxoimidazolidin-1-yl)piperidin-1-yl]-1,2,4-triazine-6-carboxamide](/img/5adc4607-a155-4409-9cfe-8e9ecb5a2168.svg "Structure of 5-[4-[4-[[1-[4-(2,4-dioxo-1,3-diazinan-1-yl)-3-methylphenyl]piperidin-4-yl]methyl]piperazin-1-yl]-3-fluoroanilino]-3-[(3R)-3-(3-methyl-2-oxoimidazolidin-1-yl)piperidin-1-yl]-1,2,4-triazine-6-carboxamide")