Account (5S,8S,10aR)-N-(4-Bromobenzyl)-5-((S)-2-(methylamino)propanamido)-6-oxo-3-(2-phenylacetyl)decahydropyrrolo[1,2-a][1,5]diazocine-8-carboxamide
- Catalog No. :
- ACKEXC641
- CAS No. :
- 1562375-46-5
- Molecular Formula :
- C29H36BrN5O4
- Molecular Weight :
- 598.54
IUPAC Name:(5S,8S,10aR)-N-(4-bromobenzyl)-5-((S)-2-(methylamino)propanamido)-6-oxo-3-(2-phenylacetyl)decahydropyrrolo[1,2-a][1,5]diazocine-8-carboxamide
![(5S,8S,10aR)-N-(4-Bromobenzyl)-5-((S)-2-(methylamino)propanamido)-6-oxo-3-(2-phenylacetyl)decahydropyrrolo[1,2-a][1,5]diazocine-8-carboxamide structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (5S,8S,10aR)-N-(4-Bromobenzyl)-5-((S)-2-(methylamino)propanamido)-6-oxo-3-(2-phenylacetyl)decahydropyrrolo[1,2-a][1,5]diazocine-8-carboxamide |
|---|---|
| IUPAC Name | (5S,8S,10aR)-N-(4-bromobenzyl)-5-((S)-2-(methylamino)propanamido)-6-oxo-3-(2-phenylacetyl)decahydropyrrolo[1,2-a][1,5]diazocine-8-carboxamide |
| Molecular Formula | C29H36BrN5O4 |
| Molecular Weight | 598.54 |
| SMILES | O=C([C@@H]1CC[C@@](CCN(C(CC2=CC=CC=C2)=O)C[C@@H]3NC([C@@H](NC)C)=O)([H])N1C3=O)NCC4=CC=C(Br)C=C4 |
| InChI Key | SOTHWYAWZKSXSA-CTZQYXLCSA-N |
| Synonym | SM-1295;SM 1295,SM1295;Pyrrolo[1,2-a][1,5]diazocine-8-carboxamide, N-[(4-bromophenyl)methyl]decahydro-5-[[(2S)-2-(methylamino)-1-oxopropyl]amino]-6-oxo-3-(2-phenylacetyl)-, (5S,8S,10aR)- |
| CAS No. | 1562375-46-5 |
Safety Data
- Pictogram
- Signal Word
- Warning
- 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. ACKEXC641 Molecular Building Block Synthetic Route
(5S,8S,10aR)-N-Benzhydryl-5-((S)-2-(methylamino)propanamido)-3-(3-methylbutanoyl)-6-oxodecahydropyrrolo[1,2-a][1,5]diazocine-8-carboxamide
(5S,8S,10aR)-N-Benzhydryl-5-((S)-2-(methylamino)propanamido)-3-(3-methylbutanoyl)-6-oxodecahydropyrrolo[1,2-a][1,5]diazocine-8-carboxamide hydrochloride
(S)-2-((5S,8S,10aR)-3-acetyl-5-amino-6-oxodecahydropyrrolo[1,2-a][1,5]diazocine-8-carboxamido)-N1-benzhydrylpentanediamide