Adaprolol
2-(1-adamantyl)ethyl 2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetate
| Molecular Formula | C26H39NO4 |
|---|---|
| Molecular Weight | 429.6 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 67.8 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 429.2879 |
| Heavy Atoms | 31 |
| Complexity | 543.0 |
Chemical Identifiers
| CAS Number | 101479-70-3 |
|---|---|
| SMILES | CC(C)NCC(COC1=CC=C(C=C1)CC(=O)OCCC23CC4CC(C2)CC(C4)C3)O |
| InChIKey | IPGLIOFIFLXLKR-UHFFFAOYSA-N |
📖 Product Overview
Adaprolol (CAS: 101479-70-3) is a chemical compound with molecular formula C26H39NO4 and molecular weight 429.6 g/mol. Its IUPAC systematic name is 2-(1-adamantyl)ethyl 2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetate.
IPGLIOFIFLXLKR-UHFFFAOYSA-N.
SMILES: CC(C)NCC(COC1=CC=C(C=C1)CC(=O)OCCC23CC4CC(C2)CC(C4)C3)O.
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