Account (2S,4S)-4-Amino-N-(2,6-difluorophenyl)-1-((S)-3,3-dimethyl-2-((S)-2-(methylamino)propanamido)butanoyl)pyrrolidine-2-carboxamide
- Catalog No. :
- ACKTQJ309
- CAS No. :
- 2891589-73-2
- Molecular Formula :
- C21H31F2N5O3
- Molecular Weight :
- 439.51
IUPAC Name:(2S,4S)-4-amino-N-(2,6-difluorophenyl)-1-((S)-3,3-dimethyl-2-((S)-2-(methylamino)propanamido)butanoyl)pyrrolidine-2-carboxamide
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Product Information
| Product Name | (2S,4S)-4-Amino-N-(2,6-difluorophenyl)-1-((S)-3,3-dimethyl-2-((S)-2-(methylamino)propanamido)butanoyl)pyrrolidine-2-carboxamide |
|---|---|
| IUPAC Name | (2S,4S)-4-amino-N-(2,6-difluorophenyl)-1-((S)-3,3-dimethyl-2-((S)-2-(methylamino)propanamido)butanoyl)pyrrolidine-2-carboxamide |
| MDL No. | MFCD34641755 |
| Molecular Formula | C21H31F2N5O3 |
| Molecular Weight | 439.51 |
| SMILES | O=C([C@H]1N(C([C@@H](NC([C@@H](NC)C)=O)C(C)(C)C)=O)C[C@@H](N)C1)NC2=C(F)C=CC=C2F |
| InChI Key | QESAPZFIIYNQSO-WXRXAMBDSA-N |
| Synonym | cIAP1 ligand 4;L-Prolinamide, N-methyl-L-alanyl-3-methyl-L-valyl-4-amino-N-(2,6-difluorophenyl)-, (4S)-;CAS:2891589-73-2 |
| CAS No. | 2891589-73-2 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319
- Precautionary Statement(s)
- P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501
Synthetic Route by SureRoute
2. ACKTQJ309 Molecular Building Block Synthetic Route
tert-Butyl ((S)-1-(((S)-1-((2S,4S)-4-amino-2-((2,6-difluorophenyl)carbamoyl)pyrrolidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl)amino)-1-oxopropan-2-yl)(methyl)carbamate
tert-Butyl ((S)-1-(((S)-1-((2S,4S)-4-azido-2-((2,6-difluorophenyl)carbamoyl)pyrrolidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl)amino)-1-oxopropan-2-yl)(methyl)carbamate
(S)-1-((S)-2-Amino-3,3-dimethylbutanoyl)-N-methyl-N-phenylpyrrolidine-2-carboxamide