TIOTROPIUM BROMIDE
(9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 2-hydroxy-2,2-dithiophen-2-ylacetate
Also Known As: TIOTROPIUM BROMIDE|AC1L1U0E|AC1Q62D4|L001459|3-Oxa-9-azoniatricyclo[3.3.1.02,4]nonane, 7-[(2-hydroxy-2,2-di-2-thienylacetyl)oxy]-9,9-dimethyl-, (1?,2?,4?,5?,7?)-|7-{[hydroxy(dithiophen-2-yl)acetyl]oxy}-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane|7-{[Hydroxydi(thiophen-2-yl)acetyl]oxy}-9,9-dimethyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]nonan-9-ium
| Molecular Formula | C19H22NO4S2+ |
|---|---|
| Molecular Weight | 392.09903 g/mol |
| LogP | 2.35 |
| Topological Polar Surface Area | 59.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 392.09903 |
| Heavy Atoms | 26 |
| Complexity | 762.5 |
Chemical Identifiers
| CAS Number | 186691-13-4 |
|---|---|
| SMILES | C[N+]1(C2CC(CC1C3C2O3)OC(=O)C(C4=CC=CS4)(C5=CC=CS5)O)C |
Product Overview
TIOTROPIUM BROMIDE (CAS 186691-13-4), with molecular formula C19H22NO4S2+ and molecular weight 392.09903 g/mol. IUPAC: (9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 2-hydroxy-2,2-dithiophen-2-ylacetate.
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