AC1L4SMN
2-[3-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanol;dihydrochloride
Also Known As: 3,8-Diazabicyclo(3.2.1)octane-8-ethanol, 3-(3-(2-trifluoromethylphenothiazin-10-yl)propyl)-, dihydrochloride|2-(3-{3-[2-(Trifluoromethyl)-10H-phenothiazin-10-yl]propyl}-3,8-diazabicyclo[3.2.1]octan-8-yl)ethan-1-ol--hydrogen chloride (1/2)|2-[3-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanol dihydrochloride|3,8-Diazabicyclo[3.2.1]octane-8-ethanol, 3-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]-, dihydrochloride
| Molecular Formula | C24H30Cl2F3N3OS |
|---|---|
| Molecular Weight | 535.14386 g/mol |
| LogP | 5.6827 |
| Topological Polar Surface Area | 55.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 535.14386 |
| Monoisotopic Mass | 535.14386 |
| Heavy Atoms | 34 |
| Complexity | 624.0 |
Chemical Identifiers
| CAS Number | 27775-17-3 |
|---|---|
| SMILES | C1CC2CN(CC1N2CCO)CCCN3C4=CC=CC=C4SC5=C3C=C(C=C5)C(F)(F)F.Cl.Cl |
| InChIKey | VIWGRYXKOCQEGM-UHFFFAOYSA-N |
Product Overview
AC1L4SMN (CAS 27775-17-3), with molecular formula C24H30Cl2F3N3OS and molecular weight 535.14386 g/mol. IUPAC: 2-[3-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]-3,8-diazabicyclo[3.2.1]octan-8-yl]ethanol;dihydrochloride.
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