2-(pyridin-3-yl)-2H-benzotriazole
TL;DR: 2-(pyridin-3-yl)-2H-benzotriazole (CAS 304871-88-3) is a chemical compound with molecular formula C11H8N4 and molecular weight 196.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyridin-3-ylbenzotriazole
Also Known As: 2-pyridin-3-ylbenzotriazole, 2-(pyridin-3-yl)-2H-benzotriazole, 2-(3-pyridinyl)-2H-1,2,3-benzotriazole, 2-(pyridin-3-yl)-2H-benzo[d][1,2,3]triazole, AN-212/12293074
| Molecular Formula | C11H8N4 |
|---|---|
| Molecular Weight | 196.07 g/mol |
| LogP | 1.8155 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.07489 |
| Heavy Atoms | 15 |
| Complexity | 552.605 |
Chemical Identifiers
| CAS Number | 304871-88-3 |
|---|---|
| SMILES | C1=CC2=NN(N=C2C=C1)C3=CN=CC=C3 |
Product Overview
2-(pyridin-3-yl)-2H-benzotriazole (CAS 304871-88-3), with molecular formula C11H8N4 and molecular weight 196.07 g/mol. IUPAC: 2-pyridin-3-ylbenzotriazole.
Chemical Property Profile of 2-(pyridin-3-yl)-2H-benzotriazole
Property Insights of 2-(pyridin-3-yl)-2H-benzotriazole
The XLogP value of 1.8155 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(pyridin-3-yl)-2H-benzotriazole. With a topological polar surface area (TPSA) of 43.6 Ų, 2-(pyridin-3-yl)-2H-benzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(pyridin-3-yl)-2H-benzotriazole 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-(pyridin-3-yl)-2H-benzotriazole?
The CAS number of 2-(pyridin-3-yl)-2H-benzotriazole is 304871-88-3.
What is the molecular formula of 2-(pyridin-3-yl)-2H-benzotriazole?
The molecular formula of 2-(pyridin-3-yl)-2H-benzotriazole is C11H8N4.
What is the molecular weight of 2-(pyridin-3-yl)-2H-benzotriazole?
The molecular weight of 2-(pyridin-3-yl)-2H-benzotriazole is 196.07 g/mol.
Where can I buy 2-(pyridin-3-yl)-2H-benzotriazole?
You can request a quote for 2-(pyridin-3-yl)-2H-benzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(pyridin-3-yl)-2H-benzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(pyridin-3-yl)-2H-benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.