Diphenhydramine salicylate
TL;DR: Diphenhydramine salicylate (CAS 7491-10-3) is a chemical compound with molecular formula C24H27NO4 and molecular weight 393.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzhydryloxy-N,N-dimethylethanamine;2-hydroxybenzoic acid
Also Known As: Benadine, Zeresmin, Ibelomin, Salibena, DIPHENHYDRAMINE SALICYLATE
| Molecular Formula | C24H27NO4 |
|---|---|
| Molecular Weight | 393.19 g/mol |
| LogP | 4.44 |
| Topological Polar Surface Area | 70.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 393.194 |
| Heavy Atoms | 29 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 7491-10-3 |
|---|---|
| SMILES | CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2.C1=CC=C(C(=C1)C(=O)O)O |
| InChIKey | RTSZUSOHOIFYSY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diphenhydramine salicylate (CAS 7491-10-3), with molecular formula C24H27NO4 and molecular weight 393.19 g/mol. IUPAC: 2-benzhydryloxy-N,N-dimethylethanamine;2-hydroxybenzoic acid.
Chemical Property Profile of Diphenhydramine salicylate
Property Insights of Diphenhydramine salicylate
The XLogP value of 4.44 indicates that Diphenhydramine salicylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diphenhydramine salicylate. Following Lipinski's Rule of Five, Diphenhydramine salicylate has 2 hydrogen bond donor(s) and 5 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 salicylate?
The CAS number of Diphenhydramine salicylate is 7491-10-3.
What is the molecular formula of Diphenhydramine salicylate?
The molecular formula of Diphenhydramine salicylate is C24H27NO4.
What is the molecular weight of Diphenhydramine salicylate?
The molecular weight of Diphenhydramine salicylate is 393.19 g/mol.
Where can I buy Diphenhydramine salicylate?
You can request a quote for Diphenhydramine salicylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diphenhydramine salicylate?
Yes, KEHONG BIO provides custom synthesis services for Diphenhydramine salicylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.