1-[3-(Benzotriazol-1-yl)propyl]benzotriazole
TL;DR: 1-[3-(Benzotriazol-1-yl)propyl]benzotriazole (CAS 93735-36-5) is a chemical compound with molecular formula C15H14N6 and molecular weight 278.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(benzotriazol-1-yl)propyl]benzotriazole
Also Known As: 1,1'-trimethylenebis(benzotriazole), 1,3-Bis(1H-benzotriazole-1-yl)propane, 1,1 -Trimethylenebis(1H-benzotriazole), 1-(3-benzotriazol-1-ylpropyl)benzotriazole, 1,1 -(Trimethylene)bis(1H-benzotriazole)
| Molecular Formula | C15H14N6 |
|---|---|
| Molecular Weight | 278.13 g/mol |
| LogP | 2.2663 |
| Topological Polar Surface Area | 61.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 278.128 |
| Heavy Atoms | 21 |
| Complexity | 817.1107 |
Chemical Identifiers
| CAS Number | 93735-36-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=NN2CCCN3C4=CC=CC=C4N=N3 |
Product Overview
1-[3-(Benzotriazol-1-yl)propyl]benzotriazole (CAS 93735-36-5), with molecular formula C15H14N6 and molecular weight 278.13 g/mol. IUPAC: 1-[3-(benzotriazol-1-yl)propyl]benzotriazole.
Chemical Property Profile of 1-[3-(Benzotriazol-1-yl)propyl]benzotriazole
Property Insights of 1-[3-(Benzotriazol-1-yl)propyl]benzotriazole
The XLogP value of 2.2663 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[3-(Benzotriazol-1-yl)propyl]benzotriazole. The TPSA of 61.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[3-(Benzotriazol-1-yl)propyl]benzotriazole. Following Lipinski's Rule of Five, 1-[3-(Benzotriazol-1-yl)propyl]benzotriazole has 0 hydrogen bond donor(s) and 4 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-[3-(Benzotriazol-1-yl)propyl]benzotriazole?
The CAS number of 1-[3-(Benzotriazol-1-yl)propyl]benzotriazole is 93735-36-5.
What is the molecular formula of 1-[3-(Benzotriazol-1-yl)propyl]benzotriazole?
The molecular formula of 1-[3-(Benzotriazol-1-yl)propyl]benzotriazole is C15H14N6.
What is the molecular weight of 1-[3-(Benzotriazol-1-yl)propyl]benzotriazole?
The molecular weight of 1-[3-(Benzotriazol-1-yl)propyl]benzotriazole is 278.13 g/mol.
Where can I buy 1-[3-(Benzotriazol-1-yl)propyl]benzotriazole?
You can request a quote for 1-[3-(Benzotriazol-1-yl)propyl]benzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-(Benzotriazol-1-yl)propyl]benzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-(Benzotriazol-1-yl)propyl]benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.