Benoxacor
TL;DR: Benoxacor (CAS 98730-04-2) is a chemical compound with molecular formula C11H11Cl2NO2 and molecular weight 259.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dichloro-1-(3-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanone
Also Known As: BENOXACOR, primextras, sofit, Benoxacor [ISO], Fenclorim
| Molecular Formula | C11H11Cl2NO2 |
|---|---|
| Molecular Weight | 259.02 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 259.0167 |
| Heavy Atoms | 16 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 98730-04-2 |
|---|---|
| SMILES | CC1COC2=CC=CC=C2N1C(=O)C(Cl)Cl |
| InChIKey | PFJJMJDEVDLPNE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benoxacor (CAS 98730-04-2), with molecular formula C11H11Cl2NO2 and molecular weight 259.02 g/mol. IUPAC: 2,2-dichloro-1-(3-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanone.
Chemical Property Profile of Benoxacor
Property Insights of Benoxacor
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benoxacor. With a topological polar surface area (TPSA) of 29.5 Ų, Benoxacor exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benoxacor has 0 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 Benoxacor?
The CAS number of Benoxacor is 98730-04-2.
What is the molecular formula of Benoxacor?
The molecular formula of Benoxacor is C11H11Cl2NO2.
What is the molecular weight of Benoxacor?
The molecular weight of Benoxacor is 259.02 g/mol.
Where can I buy Benoxacor?
You can request a quote for Benoxacor directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benoxacor?
Yes, KEHONG BIO provides custom synthesis services for Benoxacor and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.