AO-365/43113313
TL;DR: AO-365/43113313 (CAS 825604-99-7) is a chemical compound with molecular formula C17H13N7OS and molecular weight 363.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(benzotriazol-1-ylmethyl)-6-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: AO-365/43113313, 3-(benzotriazol-1-ylmethyl)-6-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 1-{[6-(phenoxymethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzotriazole, 3-(1-benzotriazolylmethyl)-6-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, [3-(1H-1,2,3-benzotriazol-1-ylmethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl phenyl ether
| Molecular Formula | C17H13N7OS |
|---|---|
| Molecular Weight | 363.09 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.09024 |
| Heavy Atoms | 26 |
| Complexity | 480.0 |
Chemical Identifiers
| CAS Number | 825604-99-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCC2=NN3C(=NN=C3S2)CN4C5=CC=CC=C5N=N4 |
| InChIKey | ISIOXVRMGJKTOA-UHFFFAOYSA-N |
Product Overview
AO-365/43113313 (CAS 825604-99-7), with molecular formula C17H13N7OS and molecular weight 363.09 g/mol. IUPAC: 3-(benzotriazol-1-ylmethyl)-6-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of AO-365/43113313
Property Insights of AO-365/43113313
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-365/43113313. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-365/43113313. Following Lipinski's Rule of Five, AO-365/43113313 has 0 hydrogen bond donor(s) and 7 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 AO-365/43113313?
The CAS number of AO-365/43113313 is 825604-99-7.
What is the molecular formula of AO-365/43113313?
The molecular formula of AO-365/43113313 is C17H13N7OS.
What is the molecular weight of AO-365/43113313?
The molecular weight of AO-365/43113313 is 363.09 g/mol.
Where can I buy AO-365/43113313?
You can request a quote for AO-365/43113313 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-365/43113313?
Yes, KEHONG BIO provides custom synthesis services for AO-365/43113313 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.