5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole
TL;DR: 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole (CAS 384369-74-8) is a chemical compound with molecular formula C14H10ClNO and molecular weight 243.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-3-(4-methylphenyl)-2,1-benzoxazole
Also Known As: ChemDiv3_002176, 5-chloro-3-(4-methylphenyl)-2,1-benzoxazole, 5-chloro-3-(p-tolyl)benzo[c]isoxazole, 5-Chloro-3-p-tolyl-benzo[c]isoxazole, 5-Chloro-3-(4-methylphenyl)-2,1-benzisoxazole
| Molecular Formula | C14H10ClNO |
|---|---|
| Molecular Weight | 243.05 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 243.04509 |
| Heavy Atoms | 17 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 384369-74-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)Cl |
| InChIKey | DRDGCJQOTIMMMY-UHFFFAOYSA-N |
Product Overview
5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole (CAS 384369-74-8), with molecular formula C14H10ClNO and molecular weight 243.05 g/mol. IUPAC: 5-chloro-3-(4-methylphenyl)-2,1-benzoxazole.
Chemical Property Profile of 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole
Property Insights of 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole
The XLogP value of 4.4 indicates that 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole 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 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole?
The CAS number of 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole is 384369-74-8.
What is the molecular formula of 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole?
The molecular formula of 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole is C14H10ClNO.
What is the molecular weight of 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole?
The molecular weight of 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole is 243.05 g/mol.
Where can I buy 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole?
You can request a quote for 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-3-(4-methylphenyl)-2,1-benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.