BAS 12975576
TL;DR: BAS 12975576 (CAS 878434-47-0) is a chemical compound with molecular formula C17H16N4O4S and molecular weight 372.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylfuran-3-yl)-6-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 12975576, 3-(2-methylfuran-3-yl)-6-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, AO-365/43300871, 3-(2-methyl-3-furyl)-6-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 3-(2-methylfuran-3-yl)-6-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C17H16N4O4S |
|---|---|
| Molecular Weight | 372.09 g/mol |
| LogP | 3.44702 |
| Topological Polar Surface Area | 83.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 372.08923 |
| Heavy Atoms | 26 |
| Complexity | 1056.7577 |
Chemical Identifiers
| CAS Number | 878434-47-0 |
|---|---|
| SMILES | CC1=C(C=CO1)C2=NN=C3N2N=C(S3)C4=CC(=C(C(=C4)OC)OC)OC |
Product Overview
BAS 12975576 (CAS 878434-47-0), with molecular formula C17H16N4O4S and molecular weight 372.09 g/mol. IUPAC: 3-(2-methylfuran-3-yl)-6-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of BAS 12975576
Property Insights of BAS 12975576
The XLogP value of 3.44702 indicates that BAS 12975576 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.91 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12975576. Following Lipinski's Rule of Five, BAS 12975576 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 12975576?
The CAS number of BAS 12975576 is 878434-47-0.
What is the molecular formula of BAS 12975576?
The molecular formula of BAS 12975576 is C17H16N4O4S.
What is the molecular weight of BAS 12975576?
The molecular weight of BAS 12975576 is 372.09 g/mol.
Where can I buy BAS 12975576?
You can request a quote for BAS 12975576 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12975576?
Yes, KEHONG BIO provides custom synthesis services for BAS 12975576 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.