Account Taragarestrant
- Catalog No. :
- ACYSLD113
- CAS No. :
- 2118899-51-5
- Molecular Formula :
- C25H25Cl2FN2O2
- Molecular Weight :
- 475.39
IUPAC Name:(E)-3-(3,5-dichloro-4-((1R,3R)-2-(2-fluoro-2-methylpropyl)-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)phenyl)acrylic acid
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Product Information
| Product Name | Taragarestrant |
|---|---|
| IUPAC Name | (E)-3-(3,5-dichloro-4-((1R,3R)-2-(2-fluoro-2-methylpropyl)-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)phenyl)acrylic acid |
| Molecular Formula | C25H25Cl2FN2O2 |
| Molecular Weight | 475.39 |
| SMILES | O=C(O)/C=C/C1=CC(Cl)=C([C@H]2N(CC(C)(F)C)[C@H](C)CC3=C2NC4=C3C=CC=C4)C(Cl)=C1 |
| InChI Key | PSJRZBBUWGIUPM-BBNFHIFMSA-N |
| Synonym | 3-(3,5-dichloro-4-((1R,3R)-2-(2-fluoro-2-methylpropyl)-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)phenyl)acrylic acid;2-Propenoic acid, 3-[3,5-dichloro-4-[(1R,3R)-2-(2-fluoro-2-methylpropyl)-2,3,4,9-tetrahydro-3-methyl-1H-pyrido[3,4-b]indol-1-yl]phenyl]-, (2E)-;ITB-102;taragarestrant;KP-2955 |
| CAS No. | 2118899-51-5 |
Synthetic Route by SureRoute
2. ACYSLD113 Molecular Building Block Synthetic Route
(2R,3R,4R,5S)-2,3,4,5-Tetrahydroxy-6-(methylamino)hexyl (E)-3-(3,5-dichloro-4-((1R,3R)-2-(2-fluoro-2-methylpropyl)-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)phenyl)acrylate
(E)-3-(3,5-Difluoro-4-((1R,3R)-2-(2-fluoro-2-methylpropyl)-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)phenyl)acrylic acid
(E)-3-(3,5-Difluoro-4-((1R,3R)-2-(2-fluoro-2-methylpropyl)-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)phenyl)acrylic acid compound with maleic acid (1:1)