Account 11-(Adamantan-1-yl)-6-hydroxy-13-(trifluoromethyl)-8-thia-3,10-diazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),5,9,11-pentaen-4-one
- Catalog No. :
- ACENCM998
- CAS No. :
- 489416-85-5
- Molecular Formula :
- C21H19F3N2O2S
- Molecular Weight :
- 420.46
IUPAC Name:7-(adamantan-1-yl)-4-hydroxy-9-(trifluoromethyl)thieno[2,3-b:4,5-b']dipyridin-2(1H)-one
![11-(Adamantan-1-yl)-6-hydroxy-13-(trifluoromethyl)-8-thia-3,10-diazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),5,9,11-pentaen-4-one structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 11-(Adamantan-1-yl)-6-hydroxy-13-(trifluoromethyl)-8-thia-3,10-diazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),5,9,11-pentaen-4-one |
|---|---|
| IUPAC Name | 7-(adamantan-1-yl)-4-hydroxy-9-(trifluoromethyl)thieno[2,3-b:4,5-b']dipyridin-2(1H)-one |
| Molecular Formula | C21H19F3N2O2S |
| Molecular Weight | 420.46 |
| SMILES | O=C1C=C(O)C2=C(C3=C(C(F)(F)F)C=C(C4(C5)CC6CC5CC(C6)C4)N=C3S2)N1 |
| InChI Key | IUGSRUNHUVSORL-UHFFFAOYSA-N |
| Synonym | 7-(1-adamantyl)-4-hydroxy-9-(trifluoromethyl)pyrido[2',3':4,5]thieno[2,3-b]pyridin-2(1H)-one |
| CAS No. | 489416-85-5 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACENCM998 Molecular Building Block Synthetic Route
11-Cyclopropyl-6-hydroxy-13-(trifluoromethyl)-8-thia-3,10-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5,10,12-pentaen-4-one
11-(Adamantan-1-yl)-8-thia-3,10-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaene-4,6-diol
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