BAS 10123826
TL;DR: BAS 10123826 (CAS 791824-08-3) is a chemical compound with molecular formula C15H10ClN5S and molecular weight 327.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(4-chlorophenyl)methyl]-3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 10123826, 6-[(4-chlorophenyl)methyl]-3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, AO-365/43113462, 6-(4-chlorobenzyl)-3-(4-pyridinyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-(4-Chloro-benzyl)-3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C15H10ClN5S |
|---|---|
| Molecular Weight | 327.03 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.03455 |
| Heavy Atoms | 22 |
| Complexity | 373.0 |
Chemical Identifiers
| CAS Number | 791824-08-3 |
|---|---|
| SMILES | C1=CC(=CC=C1CC2=NN3C(=NN=C3S2)C4=CC=NC=C4)Cl |
| InChIKey | UDRANKHJMVADNF-UHFFFAOYSA-N |
Product Overview
BAS 10123826 (CAS 791824-08-3), with molecular formula C15H10ClN5S and molecular weight 327.03 g/mol. IUPAC: 6-[(4-chlorophenyl)methyl]-3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of BAS 10123826
Property Insights of BAS 10123826
The XLogP value of 3.4 indicates that BAS 10123826 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 10123826. Following Lipinski's Rule of Five, BAS 10123826 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 BAS 10123826?
The CAS number of BAS 10123826 is 791824-08-3.
What is the molecular formula of BAS 10123826?
The molecular formula of BAS 10123826 is C15H10ClN5S.
What is the molecular weight of BAS 10123826?
The molecular weight of BAS 10123826 is 327.03 g/mol.
Where can I buy BAS 10123826?
You can request a quote for BAS 10123826 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10123826?
Yes, KEHONG BIO provides custom synthesis services for BAS 10123826 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.