Benzaprinoxide
TL;DR: Benzaprinoxide (CAS 52758-02-8) is a chemical compound with molecular formula C20H20ClNO and molecular weight 325.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(7-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,9,11,13-heptaenylidene)-N,N-dimethylpropan-1-amine oxide
Also Known As: Benzaprinoxide, Benzaprinoxidum, benzaprinoxido, Benzaprinoxida, Benzaprinoxide [INN]
| Molecular Formula | C20H20ClNO |
|---|---|
| Molecular Weight | 325.12 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 18.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.12335 |
| Heavy Atoms | 23 |
| Complexity | 470.0 |
Chemical Identifiers
| CAS Number | 52758-02-8 |
|---|---|
| SMILES | C[N+](C)(CCC=C1C2=C(C=CC3=CC=CC=C31)C(=CC=C2)Cl)[O-] |
| InChIKey | CMPHKNLTWCBULI-UHFFFAOYSA-N |
Product Overview
Benzaprinoxide (CAS 52758-02-8), with molecular formula C20H20ClNO and molecular weight 325.12 g/mol. IUPAC: 3-(7-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,9,11,13-heptaenylidene)-N,N-dimethylpropan-1-amine oxide.
Chemical Property Profile of Benzaprinoxide
Property Insights of Benzaprinoxide
The XLogP value of 4.7 indicates that Benzaprinoxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.1 Ų, Benzaprinoxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzaprinoxide has 0 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 Benzaprinoxide?
The CAS number of Benzaprinoxide is 52758-02-8.
What is the molecular formula of Benzaprinoxide?
The molecular formula of Benzaprinoxide is C20H20ClNO.
What is the molecular weight of Benzaprinoxide?
The molecular weight of Benzaprinoxide is 325.12 g/mol.
Where can I buy Benzaprinoxide?
You can request a quote for Benzaprinoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzaprinoxide?
Yes, KEHONG BIO provides custom synthesis services for Benzaprinoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.