ebastine
4-(4-benzhydryloxypiperidin-1-yl)-1-(4-tert-butylphenyl)butan-1-one
| Molecular Formula | C32H39NO2 |
|---|---|
| Molecular Weight | 469.7 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 29.5 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 469.29807 |
| Heavy Atoms | 35 |
| Complexity | 594.0 |
Chemical Identifiers
| CAS Number | 90729-43-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCC(CC2)OC(C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | MJJALKDDGIKVBE-UHFFFAOYSA-N |
📖 Product Overview
ebastine (CAS: 90729-43-4) is a chemical compound with molecular formula C32H39NO2 and molecular weight 469.7 g/mol. Its IUPAC systematic name is 4-(4-benzhydryloxypiperidin-1-yl)-1-(4-tert-butylphenyl)butan-1-one.
MJJALKDDGIKVBE-UHFFFAOYSA-N.
SMILES: CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCC(CC2)OC(C3=CC=CC=C3)C4=CC=CC=C4.
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