Account CETP-IN-4
- Catalog No. :
- ACEPEK314
- CAS No. :
- 1648889-70-6
- Molecular Formula :
- C36H28F9N3O4
- Molecular Weight :
- 737.62
IUPAC Name:4-(5-(2-((1R,5S,7aS)-1-(3,5-bis(trifluoromethyl)phenyl)-2-methyl-3-oxohexahydro-1H-pyrrolo[1,2-c]imidazol-5-yl)-4-(trifluoromethyl)phenyl)-6-methoxypyridin-3-yl)-3-methylbenzoic acid
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Product Information
| Product Name | CETP-IN-4 |
|---|---|
| IUPAC Name | 4-(5-(2-((1R,5S,7aS)-1-(3,5-bis(trifluoromethyl)phenyl)-2-methyl-3-oxohexahydro-1H-pyrrolo[1,2-c]imidazol-5-yl)-4-(trifluoromethyl)phenyl)-6-methoxypyridin-3-yl)-3-methylbenzoic acid |
| Molecular Formula | C36H28F9N3O4 |
| Molecular Weight | 737.62 |
| SMILES | O=C(O)C1=CC=C(C2=CC(C3=CC=C(C(F)(F)F)C=C3[C@@H]4CC[C@]([C@@H](C5=CC(C(F)(F)F)=CC(C(F)(F)F)=C5)N6C)([H])N4C6=O)=C(OC)N=C2)C(C)=C1 |
| InChI Key | WOQPQGXRTGWZQF-OIFRRMEBSA-N |
| Synonym | CETP-IN-4;Benzoic acid, 4-[5-[2-[(1R,5S,7aS)-1-[3,5-bis(trifluoromethyl)phenyl]hexahydro-2-methyl-3-oxo-1H-pyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-6-methoxy-3-pyridinyl]-3-methyl- |
| CAS No. | 1648889-70-6 |
Synthetic Route by SureRoute
2. ACEPEK314 Molecular Building Block Synthetic Route
4-(5-(2-((1R,5S,7aS)-1-(3,5-bis(trifluoromethyl)phenyl)-3-oxotetrahydro-1H,3H-pyrrolo[1,2-c]oxazol-5-yl)-4-(trifluoromethyl)phenyl)-6-methoxypyridin-3-yl)-3-methylbenzoic acid
![(1R)-1-[(1R)-1-[Bis[3,5-bis(trifluoromethyl)phenyl]phosphino]ethyl]-2-[2-[bis(4-methoxy-3,5-dimethylphenyl)phosphino]phenyl]Ferrocene structure diagram](https://xchemchain-prod-1253699568.cos.ap-guangzhou.myqcloud.com/production/attachments/2026/07/22/i33a/494227-30-4.png?X-Amz-Algorithm=AWS4-HMAC-SHA256&X-Amz-Credential=AKIDT0SoARehYSEnT2RxQiomY7TcckkZDlIx%2F20260801%2Fap-guangzhou%2Fs3%2Faws4_request&X-Amz-Date=20260801T112621Z&X-Amz-Expires=86400&X-Amz-SignedHeaders=host&response-content-disposition=attachment%3B%20filename%3D%22494227-30-4.png%22&x-id=GetObject&X-Amz-Signature=9b1102920c4351b3442bf3829e1a7d5478089dfa4e95e45f2e53e2173387c59c)
(1R)-1-[(1R)-1-[Bis[3,5-bis(trifluoromethyl)phenyl]phosphino]ethyl]-2-[2-[bis(4-methoxy-3,5-dimethylphenyl)phosphino]phenyl]Ferrocene
(R,R')-2,2''-Bis(diphenylphosphino)-1,1''-biferrocene