Ru-Tuss
TL;DR: Ru-Tuss (CAS 79329-85-4) is a chemical compound with molecular formula C89H119BrCl3N7O17 and molecular weight 1741.69 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-amino-1-phenylpropan-1-ol;(E)-but-2-enedioic acid;3-(4-chlorophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine;3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol;bis(3-hydroxy-2-[3-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)phenyl]propanoic acid);3-hydroxy-2-[2-[(1S,2S,4R,5R)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl]phenyl]propanoic acid;hydrobromide;dihydrochloride
Also Known As: Ru-Tuss, Atropine sulfate mixture with chlorpheniramine maleate, phenylephrine ydrochloride, phenylpropanolamine hydrochloride, hyoscyamine and scopolamine hydrobromide, 8-Methyl-8-azabicyclo(3.2.1)oct-3-yl alpha-(hydroxymethyl)benzeneacetate (3(S)-endo)-, mixt. with (R*,S*)-(+-)-alpha-(1-aminoethyl)benzenemethanol hydrochloride, gamma-(4-chlorophenyl)-N,N-dimethyl-2-pyridinepropanamine (Z)-2-butenedioate(1:1), (R)-3-hydroxy-alpha-((methylamino)methyl)benzenemethanol hydrochloride, endo-(+-)-8-methyl-8-azabicyclo(3.2.1)oct-3-yl alpha-(hydroxymethyl)benzeneacetate and (7(S)-(1alpha,2beta,4eta,5alpha,7alpha))-9-met, 8-Methyl-8-azabicyclo(3.2.1)oct-3-yl alpha-(hydroxymethyl)benzeneacetate (3(S)-endo)-, mixt. with (R*,S*)-(+-)-alpha-(1-aminoethyl)benzenemethanol hydrochloride, gamma-(4-chlorophenyl)-N,N-dimethyl-2-pyridinepropanamine (Z)-2-butenedioate(1:1), (R)-3-hydroxy-alpha-((methylamino)methyl)benzenemethanol hydrochloride, endo-(+-)-8-methyl-8-azabicyclo(3.2.1)oct-3-yl alpha-(hydroxymethyl)benzeneacetate and (7(S)-(1alpha,2beta,4eta,5alpha,7alpha))-9-methyl-3-oxa-9-azatricyclo(3.3.1.0(2,4))non-7-yl alpha-(hydroxymethyl)benzeneacetate hydrobromide, Benzeneacetic acid, alpha-(hydroxymethyl)-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, (3(S)-endo)-, mixt. with (R*,S*)-(+-)-alpha-(1-aminoethyl)benzenemethanol hydrochloride, gamma-(4-chlorophenyl)-N,N-dimethyl-2-pyridinepropanamine (Z)-2-butenedioate(1:1), (R)-3-hydroxy-alpha-((methylamino)methyl)benzenemethanol hydrochloride, endo-(+-)-8-methyl-8-azabicyclo(3.2.1)oct-3-yl alpha-(hydroxymethyl)benzeneacetate and (7(S)-(1alpha,2beta,4eta,5alpha,7alpha))-9-methyl-3-oxa-9-azatricyclo(3.3.1.0(2,4))non-7-yl alpha-(hydroxymethyl)benzeneacetate hydrobromide
| Molecular Formula | C89H119BrCl3N7O17 |
|---|---|
| Molecular Weight | 1741.69 g/mol |
| LogP | 12.2132 |
| Topological Polar Surface Area | 384.31 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 24 |
| Exact Mass | 1741.6912 |
| Heavy Atoms | 117 |
| Complexity | 4064.1858 |
Chemical Identifiers
| CAS Number | 79329-85-4 |
|---|---|
| SMILES | C[C@H](C(C1=CC=CC=C1)O)N.CNC[C@@H](C1=CC(=CC=C1)O)O.CN1[C@@H]2CC(C[C@H]1[C@H]3[C@@H]2O3)C4=CC=CC=C4C(CO)C(=O)O.CN1C2CCC1CC(C2)C3=CC(=CC=C3)C(CO)C(=O)O.CN1C2CCC1CC(C2)C3=CC(=CC=C3)C(CO)C(=O)O.CN(C)CCC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2.C(=C/C(=O)O)\C(=O)O.Cl.Cl.Br |
Product Overview
Ru-Tuss (CAS 79329-85-4), with molecular formula C89H119BrCl3N7O17 and molecular weight 1741.69 g/mol. IUPAC: (2R)-2-amino-1-phenylpropan-1-ol;(E)-but-2-enedioic acid;3-(4-chlorophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine;3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol;bis(3-hydroxy-2-[3-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)phenyl]propanoic acid);3-hydroxy-2-[2-[(1S,2S,4R,5R)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl]phenyl]propanoic acid;hydrobromide;dihydrochloride.
Chemical Property Profile of Ru-Tuss
Property Insights of Ru-Tuss
The XLogP value of 12.2132 indicates that Ru-Tuss is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 384.31 Ų indicates high polarity, suggesting Ru-Tuss may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ru-Tuss has 13 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ru-Tuss?
The CAS number of Ru-Tuss is 79329-85-4.
What is the molecular formula of Ru-Tuss?
The molecular formula of Ru-Tuss is C89H119BrCl3N7O17.
What is the molecular weight of Ru-Tuss?
The molecular weight of Ru-Tuss is 1741.69 g/mol.
Where can I buy Ru-Tuss?
You can request a quote for Ru-Tuss directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ru-Tuss?
Yes, KEHONG BIO provides custom synthesis services for Ru-Tuss and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.