Epinastine Hydrochloride
TL;DR: Epinastine Hydrochloride (CAS 127786-29-2) is a chemical compound with molecular formula C16H16ClN3 and molecular weight 285.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-diazatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),3,7,9,11,14,16-heptaen-3-amine;hydrochloride
Also Known As: Epinastine hydrochloride, Epinastine HCl, Alesion, Elestat, epinastine
| Molecular Formula | C16H16ClN3 |
|---|---|
| Molecular Weight | 285.10 g/mol |
| LogP | 2.8886 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 285.10327 |
| Heavy Atoms | 20 |
| Complexity | 378.0 |
Chemical Identifiers
| CAS Number | 127786-29-2 |
|---|---|
| SMILES | C1C2C3=CC=CC=C3CC4=CC=CC=C4N2C(=N1)N.Cl |
| InChIKey | VKXSGUIOOQPGAF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Epinastine Hydrochloride (CAS 127786-29-2), with molecular formula C16H16ClN3 and molecular weight 285.10 g/mol. IUPAC: 2,4-diazatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),3,7,9,11,14,16-heptaen-3-amine;hydrochloride.
Chemical Property Profile of Epinastine Hydrochloride
Property Insights of Epinastine Hydrochloride
The XLogP value of 2.8886 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Epinastine Hydrochloride. With a topological polar surface area (TPSA) of 41.6 Ų, Epinastine Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Epinastine Hydrochloride has 2 hydrogen bond donor(s) and 1 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 Epinastine Hydrochloride?
The CAS number of Epinastine Hydrochloride is 127786-29-2.
What is the molecular formula of Epinastine Hydrochloride?
The molecular formula of Epinastine Hydrochloride is C16H16ClN3.
What is the molecular weight of Epinastine Hydrochloride?
The molecular weight of Epinastine Hydrochloride is 285.10 g/mol.
Where can I buy Epinastine Hydrochloride?
You can request a quote for Epinastine Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Epinastine Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Epinastine Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.