1,2,3-Triazole analogue, 16
TL;DR: 1,2,3-Triazole analogue, 16 (CAS 59066-79-4) is a chemical compound with molecular formula C8H6BrN3 and molecular weight 222.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-bromophenyl)-2H-triazole
Also Known As: 4-(4-bromophenyl)-1H-1,2,3-triazole, 4-(4-bromophenyl)-2H-triazole, MetAP2-IN-1, p-bromophenyl triazol, MetAP-2-IN-6
| Molecular Formula | C8H6BrN3 |
|---|---|
| Molecular Weight | 222.97 g/mol |
| LogP | 2.2342 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.9745 |
| Heavy Atoms | 12 |
| Complexity | 352.30182 |
Chemical Identifiers
| CAS Number | 59066-79-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NNN=C2)Br |
Product Overview
1,2,3-Triazole analogue, 16 (CAS 59066-79-4), with molecular formula C8H6BrN3 and molecular weight 222.97 g/mol. IUPAC: 4-(4-bromophenyl)-2H-triazole.
Chemical Property Profile of 1,2,3-Triazole analogue, 16
Property Insights of 1,2,3-Triazole analogue, 16
The XLogP value of 2.2342 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3-Triazole analogue, 16. With a topological polar surface area (TPSA) of 41.57 Ų, 1,2,3-Triazole analogue, 16 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3-Triazole analogue, 16 has 1 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 1,2,3-Triazole analogue, 16?
The CAS number of 1,2,3-Triazole analogue, 16 is 59066-79-4.
What is the molecular formula of 1,2,3-Triazole analogue, 16?
The molecular formula of 1,2,3-Triazole analogue, 16 is C8H6BrN3.
What is the molecular weight of 1,2,3-Triazole analogue, 16?
The molecular weight of 1,2,3-Triazole analogue, 16 is 222.97 g/mol.
Where can I buy 1,2,3-Triazole analogue, 16?
You can request a quote for 1,2,3-Triazole analogue, 16 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3-Triazole analogue, 16?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3-Triazole analogue, 16 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.