Bis(1H-benzotriazol-1-yl)methanone
TL;DR: Bis(1H-benzotriazol-1-yl)methanone (CAS 68985-05-7) is a chemical compound with molecular formula C13H8N6O and molecular weight 264.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(benzotriazol-1-yl)methanone
Also Known As: bis(benzotriazol-1-yl)methanone, Dibenzotriazol-1-ylmethanone, di(1H-1,2,3-benzotriazol-1-yl)methanone, Bis(1H-benzotriazol-1-yl)methanone, 1,1'-CARBONYLBISBENZOTRIAZOLE
| Molecular Formula | C13H8N6O |
|---|---|
| Molecular Weight | 264.08 g/mol |
| LogP | 1.6924 |
| Topological Polar Surface Area | 78.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 264.07596 |
| Heavy Atoms | 20 |
| Complexity | 862.00824 |
Chemical Identifiers
| CAS Number | 68985-05-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=NN2C(=O)N3C4=CC=CC=C4N=N3 |
Product Overview
Bis(1H-benzotriazol-1-yl)methanone (CAS 68985-05-7), with molecular formula C13H8N6O and molecular weight 264.08 g/mol. IUPAC: bis(benzotriazol-1-yl)methanone.
Chemical Property Profile of Bis(1H-benzotriazol-1-yl)methanone
Property Insights of Bis(1H-benzotriazol-1-yl)methanone
The XLogP value of 1.6924 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(1H-benzotriazol-1-yl)methanone. The TPSA of 78.49 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(1H-benzotriazol-1-yl)methanone. Following Lipinski's Rule of Five, Bis(1H-benzotriazol-1-yl)methanone has 0 hydrogen bond donor(s) and 5 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 Bis(1H-benzotriazol-1-yl)methanone?
The CAS number of Bis(1H-benzotriazol-1-yl)methanone is 68985-05-7.
What is the molecular formula of Bis(1H-benzotriazol-1-yl)methanone?
The molecular formula of Bis(1H-benzotriazol-1-yl)methanone is C13H8N6O.
What is the molecular weight of Bis(1H-benzotriazol-1-yl)methanone?
The molecular weight of Bis(1H-benzotriazol-1-yl)methanone is 264.08 g/mol.
Where can I buy Bis(1H-benzotriazol-1-yl)methanone?
You can request a quote for Bis(1H-benzotriazol-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(1H-benzotriazol-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for Bis(1H-benzotriazol-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.