Diphenhydramine Hydrochloride
TL;DR: Diphenhydramine Hydrochloride (CAS 147-24-0) is a chemical compound with molecular formula C17H22ClNO and molecular weight 291.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzhydryloxy-N,N-dimethylethanamine;hydrochloride
Also Known As: DIPHENHYDRAMINE HYDROCHLORIDE, Diphenhydramine HCl, Benadryl, Dimedrol, Allergival
| Molecular Formula | C17H22ClNO |
|---|---|
| Molecular Weight | 291.14 g/mol |
| LogP | 3.78 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 291.13898 |
| Heavy Atoms | 20 |
| Complexity | 211.0 |
| Melting Point | 331 to 170.0 °C |
| Solubility | greater than or equal to 100 mg/mL at 70.7 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 147-24-0 |
|---|---|
| SMILES | CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2.Cl |
| InChIKey | PCHPORCSPXIHLZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diphenhydramine Hydrochloride (CAS 147-24-0), with molecular formula C17H22ClNO and molecular weight 291.14 g/mol. IUPAC: 2-benzhydryloxy-N,N-dimethylethanamine;hydrochloride.
Chemical Property Profile of Diphenhydramine Hydrochloride
Property Insights of Diphenhydramine Hydrochloride
The XLogP value of 3.78 indicates that Diphenhydramine Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, Diphenhydramine Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diphenhydramine Hydrochloride has 1 hydrogen bond donor(s) and 2 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 Diphenhydramine Hydrochloride?
The CAS number of Diphenhydramine Hydrochloride is 147-24-0.
What is the molecular formula of Diphenhydramine Hydrochloride?
The molecular formula of Diphenhydramine Hydrochloride is C17H22ClNO.
What is the molecular weight of Diphenhydramine Hydrochloride?
The molecular weight of Diphenhydramine Hydrochloride is 291.14 g/mol.
Where can I buy Diphenhydramine Hydrochloride?
You can request a quote for Diphenhydramine Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diphenhydramine Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Diphenhydramine Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.