Lyspafen
TL;DR: Lyspafen (CAS 79568-96-0) is a chemical compound with molecular formula C62H76N4O12S and molecular weight 1100.52 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-cyano-3,3-diphenylpropyl)-4-phenylpiperidine-4-carboxylic acid;bis([(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 3-hydroxy-2-phenylpropanoate);sulfuric acid
Also Known As: Lyspafen, Motofen, Atropine sulfate mixture with difenoxin, Atropine mixture with difenoxin, MOTOFEN HALF-STRENGTH
| Molecular Formula | C62H76N4O12S |
|---|---|
| Molecular Weight | 1100.52 g/mol |
| LogP | 8.21378 |
| Topological Polar Surface Area | 247.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 17 |
| Exact Mass | 1100.5181 |
| Heavy Atoms | 79 |
| Complexity | 1070.0 |
Chemical Identifiers
| CAS Number | 79568-96-0 |
|---|---|
| SMILES | CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3.CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3.C1CN(CCC1(C2=CC=CC=C2)C(=O)O)CCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4.OS(=O)(=O)O |
| InChIKey | RHIPZHIKEJCGKT-ZGKYKXMASA-N |
Product Overview
Lyspafen (CAS 79568-96-0), with molecular formula C62H76N4O12S and molecular weight 1100.52 g/mol. IUPAC: 1-(3-cyano-3,3-diphenylpropyl)-4-phenylpiperidine-4-carboxylic acid;bis([(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 3-hydroxy-2-phenylpropanoate);sulfuric acid.
Chemical Property Profile of Lyspafen
Property Insights of Lyspafen
The XLogP value of 8.21378 indicates that Lyspafen is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 247.0 Ų indicates high polarity, suggesting Lyspafen may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Lyspafen has 5 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Lyspafen?
The CAS number of Lyspafen is 79568-96-0.
What is the molecular formula of Lyspafen?
The molecular formula of Lyspafen is C62H76N4O12S.
What is the molecular weight of Lyspafen?
The molecular weight of Lyspafen is 1100.52 g/mol.
Where can I buy Lyspafen?
You can request a quote for Lyspafen directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lyspafen?
Yes, KEHONG BIO provides custom synthesis services for Lyspafen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.