2,5-Dimethylphenyl5-bromonicotinate
TL;DR: 2,5-Dimethylphenyl5-bromonicotinate (CAS 723255-56-9) is a chemical compound with molecular formula C14H12BrNO2 and molecular weight 305.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dimethylphenyl) 5-bromopyridine-3-carboxylate
Also Known As: 2,5-dimethylphenyl5-bromonicotinate, (2,5-dimethylphenyl) 5-bromopyridine-3-carboxylate, AN-652/42233928
| Molecular Formula | C14H12BrNO2 |
|---|---|
| Molecular Weight | 305.01 g/mol |
| LogP | 3.68014 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 305.00513 |
| Heavy Atoms | 18 |
| Complexity | 596.0979 |
Chemical Identifiers
| CAS Number | 723255-56-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)OC(=O)C2=CC(=CN=C2)Br |
Product Overview
2,5-Dimethylphenyl5-bromonicotinate (CAS 723255-56-9), with molecular formula C14H12BrNO2 and molecular weight 305.01 g/mol. IUPAC: (2,5-dimethylphenyl) 5-bromopyridine-3-carboxylate.
Chemical Property Profile of 2,5-Dimethylphenyl5-bromonicotinate
Property Insights of 2,5-Dimethylphenyl5-bromonicotinate
The XLogP value of 3.68014 indicates that 2,5-Dimethylphenyl5-bromonicotinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.19 Ų, 2,5-Dimethylphenyl5-bromonicotinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dimethylphenyl5-bromonicotinate has 0 hydrogen bond donor(s) and 3 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 2,5-Dimethylphenyl5-bromonicotinate?
The CAS number of 2,5-Dimethylphenyl5-bromonicotinate is 723255-56-9.
What is the molecular formula of 2,5-Dimethylphenyl5-bromonicotinate?
The molecular formula of 2,5-Dimethylphenyl5-bromonicotinate is C14H12BrNO2.
What is the molecular weight of 2,5-Dimethylphenyl5-bromonicotinate?
The molecular weight of 2,5-Dimethylphenyl5-bromonicotinate is 305.01 g/mol.
Where can I buy 2,5-Dimethylphenyl5-bromonicotinate?
You can request a quote for 2,5-Dimethylphenyl5-bromonicotinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dimethylphenyl5-bromonicotinate?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dimethylphenyl5-bromonicotinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.