氧化洛哌丁胺
TL;DR: 氧化洛哌丁胺 (CAS 106900-12-3) is a chemical compound with molecular formula C29H33ClN2O3 and molecular weight 492.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氧化洛哌丁胺
4-[4-(4-chlorophenyl)-4-hydroxy-1-oxidopiperidin-1-ium-1-yl]-N,N-dimethyl-2,2-diphenylbutanamide
Also Known As: Loperamide oxide, Loperamide N-oxide, Arestal, loperamide, Loperamide EP impurity G
| Molecular Formula | C29H33ClN2O3 |
|---|---|
| Molecular Weight | 492.22 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 492.21796 |
| Heavy Atoms | 35 |
| Complexity | 668.0 |
Chemical Identifiers
| CAS Number | 106900-12-3 |
|---|---|
| SMILES | CN(C)C(=O)C(CC[N+]1(CCC(CC1)(C2=CC=C(C=C2)Cl)O)[O-])(C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | KXVSBTJVTUVNPM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氧化洛哌丁胺 (CAS 106900-12-3), with molecular formula C29H33ClN2O3 and molecular weight 492.22 g/mol. IUPAC: 4-[4-(4-chlorophenyl)-4-hydroxy-1-oxidopiperidin-1-ium-1-yl]-N,N-dimethyl-2,2-diphenylbutanamide.
Chemical Property Profile of 氧化洛哌丁胺
Property Insights of 氧化洛哌丁胺
The XLogP value of 4.5 indicates that 氧化洛哌丁胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.6 Ų, 氧化洛哌丁胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氧化洛哌丁胺 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 氧化洛哌丁胺?
The CAS number of 氧化洛哌丁胺 is 106900-12-3.
What is the molecular formula of 氧化洛哌丁胺?
The molecular formula of 氧化洛哌丁胺 is C29H33ClN2O3.
What is the molecular weight of 氧化洛哌丁胺?
The molecular weight of 氧化洛哌丁胺 is 492.22 g/mol.
Where can I buy 氧化洛哌丁胺?
You can request a quote for 氧化洛哌丁胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氧化洛哌丁胺?
Yes, KEHONG BIO provides custom synthesis services for 氧化洛哌丁胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.