BAS 10123685
TL;DR: BAS 10123685 (CAS 537017-84-8) is a chemical compound with molecular formula C19H18N4O4S and molecular weight 398.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 10123685, 6-(4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-(4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, AA-504/33805036, 1,2,3-trimethoxy-5-[6-(4-methoxyphenyl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazoli n-3-yl)]benzene
| Molecular Formula | C19H18N4O4S |
|---|---|
| Molecular Weight | 398.10 g/mol |
| LogP | 3.5542 |
| Topological Polar Surface Area | 80.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.1049 |
| Heavy Atoms | 28 |
| Complexity | 1095.8739 |
Chemical Identifiers
| CAS Number | 537017-84-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN3C(=NN=C3S2)C4=CC(=C(C(=C4)OC)OC)OC |
Product Overview
BAS 10123685 (CAS 537017-84-8), with molecular formula C19H18N4O4S and molecular weight 398.10 g/mol. IUPAC: 6-(4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of BAS 10123685
Property Insights of BAS 10123685
The XLogP value of 3.5542 indicates that BAS 10123685 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 10123685. Following Lipinski's Rule of Five, BAS 10123685 has 0 hydrogen bond donor(s) and 8 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 10123685?
The CAS number of BAS 10123685 is 537017-84-8.
What is the molecular formula of BAS 10123685?
The molecular formula of BAS 10123685 is C19H18N4O4S.
What is the molecular weight of BAS 10123685?
The molecular weight of BAS 10123685 is 398.10 g/mol.
Where can I buy BAS 10123685?
You can request a quote for BAS 10123685 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10123685?
Yes, KEHONG BIO provides custom synthesis services for BAS 10123685 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.