2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide
TL;DR: 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide (CAS 328918-93-0) is a chemical compound with molecular formula C11H10BrNO2 and molecular weight 266.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-bromophenyl)-4,5-dimethyl-3-oxido-1,3-oxazol-3-ium
Also Known As: 2-(3-bromophenyl)-4,5-dimethyloxazole-3-oxide, Oxazole,2-(3-bromophenyl)-4,5-dimethyl-,3-oxide, 2-(3-bromophenyl)-4,5-dimethyl-3-oxido-1,3-oxazol-3-ium, BRD-K17838087-001-07-0, Oxazole, 2-(3-bromophenyl)-4,5-dimethyl-, 3-oxide
| Molecular Formula | C11H10BrNO2 |
|---|---|
| Molecular Weight | 266.99 g/mol |
| LogP | 2.95934 |
| Topological Polar Surface Area | 40.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 266.9895 |
| Heavy Atoms | 15 |
| Complexity | 505.28418 |
Chemical Identifiers
| CAS Number | 328918-93-0 |
|---|---|
| SMILES | CC1=C(OC(=[N+]1[O-])C2=CC(=CC=C2)Br)C |
Product Overview
2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide (CAS 328918-93-0), with molecular formula C11H10BrNO2 and molecular weight 266.99 g/mol. IUPAC: 2-(3-bromophenyl)-4,5-dimethyl-3-oxido-1,3-oxazol-3-ium.
Chemical Property Profile of 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide
Property Insights of 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide
The XLogP value of 2.95934 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide. With a topological polar surface area (TPSA) of 40.08 Ų, 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide 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 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide?
The CAS number of 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide is 328918-93-0.
What is the molecular formula of 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide?
The molecular formula of 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide is C11H10BrNO2.
What is the molecular weight of 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide?
The molecular weight of 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide is 266.99 g/mol.
Where can I buy 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide?
You can request a quote for 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Bromophenyl)-4,5-dimethyloxazole-3-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.