NEXERIDINE
TL;DR: NEXERIDINE (CAS 53716-47-5) is a chemical compound with molecular formula C19H30ClNO2 and molecular weight 339.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-[1-(dimethylamino)propan-2-yl]-2-phenylcyclohexane-1-carboxylate;hydrochloride
Also Known As: NEXERIDINE HYDROCHLORIDE, Nexeridine hydrochloride (USAN), Methyl 1-[1-(dimethylamino)propan-2-yl]-2-phenylcyclohexane-1-carboxylate--hydrogen chloride (1/1), methyl 1-[1-(dimethylamino)propan-2-yl]-2-phenylcyclohexane-1-carboxylate hydrochloride
| Molecular Formula | C19H30ClNO2 |
|---|---|
| Molecular Weight | 339.20 g/mol |
| LogP | 4.12 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 339.1965 |
| Heavy Atoms | 23 |
| Complexity | 362.0 |
Chemical Identifiers
| CAS Number | 53716-47-5 |
|---|---|
| SMILES | CC(CN(C)C)C1(CCCCC1C2=CC=CC=C2)C(=O)OC.Cl |
| InChIKey | UCPLBINOMYVRHO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
NEXERIDINE (CAS 53716-47-5), with molecular formula C19H30ClNO2 and molecular weight 339.20 g/mol. IUPAC: methyl 1-[1-(dimethylamino)propan-2-yl]-2-phenylcyclohexane-1-carboxylate;hydrochloride.
Chemical Property Profile of NEXERIDINE
Property Insights of NEXERIDINE
The XLogP value of 4.12 indicates that NEXERIDINE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, NEXERIDINE exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, NEXERIDINE 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 NEXERIDINE?
The CAS number of NEXERIDINE is 53716-47-5.
What is the molecular formula of NEXERIDINE?
The molecular formula of NEXERIDINE is C19H30ClNO2.
What is the molecular weight of NEXERIDINE?
The molecular weight of NEXERIDINE is 339.20 g/mol.
Where can I buy NEXERIDINE?
You can request a quote for NEXERIDINE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NEXERIDINE?
Yes, KEHONG BIO provides custom synthesis services for NEXERIDINE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.