AC1Q3ETG
1-[3-(benzenesulfonyl)propyl]-4-phenyl-3,6-dihydro-2H-pyridine;hydrochloride
Also Known As: CV-961|Pyridine, 1,2,3,6-tetrahydro-4-phenyl-1-(3-(phenylsulfonyl)propyl)-, monohydrochloride|1,2,3,6-Tetrahydro-4-phenyl-1-(3-(phenylsulfonyl)propyl)pyridine hydrochloride|4-phenyl-1-[3-(phenylsulfonyl)propyl]-1,2,3,6-tetrahydropyridine hydrochloride(1:1)|1-[3-(benzenesulfonyl)propyl]-4-phenyl-3,6-dihydro-2H-pyridine hydrochloride|1-[3-(benzenesulfonyl)propyl]-4-phenyl-3,6-dihydro-2H-pyridine,hydrochloride|1-[3-(Benzenesulfonyl)propyl]-4-phenyl-1,2,3,6-tetrahydropyridine--hydrogen chloride (1/1)
| Molecular Formula | C20H24ClNO2S |
|---|---|
| Molecular Weight | 377.12164 g/mol |
| LogP | 4.0615 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 377.12164 |
| Monoisotopic Mass | 377.12164 |
| Heavy Atoms | 25 |
| Complexity | 508.0 |
Chemical Identifiers
| CAS Number | 40312-25-2 |
|---|---|
| SMILES | C1CN(CC=C1C2=CC=CC=C2)CCCS(=O)(=O)C3=CC=CC=C3.Cl |
| InChIKey | FIAKIQWRSCZXAU-UHFFFAOYSA-N |
Product Overview
AC1Q3ETG (CAS 40312-25-2), with molecular formula C20H24ClNO2S and molecular weight 377.12164 g/mol. IUPAC: 1-[3-(benzenesulfonyl)propyl]-4-phenyl-3,6-dihydro-2H-pyridine;hydrochloride.
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