Peroben
TL;DR: Peroben (CAS 78371-63-8) is a chemical compound with molecular formula C26H34N2O3 and molecular weight 422.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzhydryloxy-N,N-dimethylethanamine;3,3-diethyl-1H-pyridine-2,4-dione
Also Known As: Peroben, p-Ethoxybenzylidene p-cyanoaniline, Diphenhydramine mixture with pyrithyldione, SID:134224934, 2-benzhydryloxy-N,N-dimethylethanamine;3,3-diethyl-1H-pyridine-2,4-dione
| Molecular Formula | C26H34N2O3 |
|---|---|
| Molecular Weight | 422.26 g/mol |
| LogP | 4.3596 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 422.25696 |
| Heavy Atoms | 31 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 78371-63-8 |
|---|---|
| SMILES | CCC1(C(=O)C=CNC1=O)CC.CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2 |
| InChIKey | MVTGWTQHRFIHGV-UHFFFAOYSA-N |
Product Overview
Peroben (CAS 78371-63-8), with molecular formula C26H34N2O3 and molecular weight 422.26 g/mol. IUPAC: 2-benzhydryloxy-N,N-dimethylethanamine;3,3-diethyl-1H-pyridine-2,4-dione.
Chemical Property Profile of Peroben
Property Insights of Peroben
The XLogP value of 4.3596 indicates that Peroben is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.6 Ų, Peroben exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Peroben has 1 hydrogen bond donor(s) and 4 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 Peroben?
The CAS number of Peroben is 78371-63-8.
What is the molecular formula of Peroben?
The molecular formula of Peroben is C26H34N2O3.
What is the molecular weight of Peroben?
The molecular weight of Peroben is 422.26 g/mol.
Where can I buy Peroben?
You can request a quote for Peroben directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Peroben?
Yes, KEHONG BIO provides custom synthesis services for Peroben and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.