Account (S)-3-((S)-2-(2-((2,6-difluorophenyl)amino)-2-oxoacetamido)propanamido)-4-oxo-5-(2,3,5,6-tetrafluorophenoxy)pentanoic acid
- Catalog No. :
- ACBKPI751
- CAS No. :
- 254750-11-3
- Molecular Formula :
- C22H17F6N3O7
- Molecular Weight :
- 549.38
IUPAC Name:(S)-3-((S)-2-(2-((2,6-difluorophenyl)amino)-2-oxoacetamido)propanamido)-4-oxo-5-(2,3,5,6-tetrafluorophenoxy)pentanoic acid
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Product Information
| Product Name | (S)-3-((S)-2-(2-((2,6-difluorophenyl)amino)-2-oxoacetamido)propanamido)-4-oxo-5-(2,3,5,6-tetrafluorophenoxy)pentanoic acid |
|---|---|
| IUPAC Name | (S)-3-((S)-2-(2-((2,6-difluorophenyl)amino)-2-oxoacetamido)propanamido)-4-oxo-5-(2,3,5,6-tetrafluorophenoxy)pentanoic acid |
| Molecular Formula | C22H17F6N3O7 |
| Molecular Weight | 549.38 |
| SMILES | O=C(C[C@@H](C(COC1=C(C(F)=CC(F)=C1F)F)=O)NC([C@H](C)NC(C(NC2=C(C=CC=C2F)F)=O)=O)=O)O |
| InChI Key | VMPUKWSLCRUGSR-SDBXPKJASA-N |
| Synonym | IDN-7314;L-Alaninamide, N-(2,6-difluorophenyl)-2-oxoglycyl-N-[(1S)-1-(carboxymethyl)-2-oxo-3-(2,3,5,6-tetrafluorophenoxy)propyl]- |
| CAS No. | 254750-11-3 |
Safety Data
- Pictogram
- Signal Word
- Gefahr
- Hazard Statement(s)
- H302-H319-H372-H410
- Precautionary Statement(s)
- P260-P264-P273-P301+P312-P305+P351+P338-P314
Synthetic Route by SureRoute
2. ACBKPI751 Molecular Building Block Synthetic Route
(S)-3-((S)-2-(2-((2-(tert-Butyl)phenyl)amino)-2-oxoacetamido)propanamido)-4-oxo-5-(2,3,5,6-tetrafluorophenoxy)pentanoic acid
tert-butyl (S)-3-((S)-2-(2-((2-(tert-butyl)phenyl)amino)-2-oxoacetamido)propanamido)-4-oxo-5-(2,3,5,6-tetrafluorophenoxy)pentanoate
tert-butyl (3S)-3-((S)-2-(2-((2-(tert-butyl)phenyl)amino)-2-oxoacetamido)propanamido)-4-hydroxy-5-(2,3,5,6-tetrafluorophenoxy)pentanoate