1-(piperidin-4-yl)-1H-1,2,3-benzotriazole
TL;DR: 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole (CAS 79098-96-7) is a chemical compound with molecular formula C11H14N4 and molecular weight 202.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-piperidin-4-ylbenzotriazole
Also Known As: 1-piperidin-4-ylbenzotriazole, 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole, 1H-Benzotriazole, 1-(4-piperidinyl)-, 1-(Piperidin-4-yl)-1H-benzo[d][1,2,3]triazole, SDCCGMLS-0066149.P001
| Molecular Formula | C11H14N4 |
|---|---|
| Molecular Weight | 202.12 g/mol |
| LogP | 1.3558 |
| Topological Polar Surface Area | 42.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 202.12184 |
| Heavy Atoms | 15 |
| Complexity | 456.3108 |
Chemical Identifiers
| CAS Number | 79098-96-7 |
|---|---|
| SMILES | C1CNCCC1N2C3=CC=CC=C3N=N2 |
Product Overview
1-(piperidin-4-yl)-1H-1,2,3-benzotriazole (CAS 79098-96-7), with molecular formula C11H14N4 and molecular weight 202.12 g/mol. IUPAC: 1-piperidin-4-ylbenzotriazole.
Chemical Property Profile of 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole
Property Insights of 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole
The XLogP value of 1.3558 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole. With a topological polar surface area (TPSA) of 42.74 Ų, 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole has 1 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 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole?
The CAS number of 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole is 79098-96-7.
What is the molecular formula of 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole?
The molecular formula of 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole is C11H14N4.
What is the molecular weight of 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole?
The molecular weight of 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole is 202.12 g/mol.
Where can I buy 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole?
You can request a quote for 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(piperidin-4-yl)-1H-1,2,3-benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.