BAS 12975747
TL;DR: BAS 12975747 (CAS 878436-06-7) is a chemical compound with molecular formula C16H12N4O2S2 and molecular weight 356.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-thiophen-2-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 12975747, AO-365/43300697, 6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-thiophen-2-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(2-thienyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-3-(thiophen-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C16H12N4O2S2 |
|---|---|
| Molecular Weight | 356.04 g/mol |
| LogP | 3.2763 |
| Topological Polar Surface Area | 61.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 356.04016 |
| Heavy Atoms | 24 |
| Complexity | 1006.6187 |
Chemical Identifiers
| CAS Number | 878436-06-7 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)CC3=NN4C(=NN=C4S3)C5=CC=CS5 |
Product Overview
BAS 12975747 (CAS 878436-06-7), with molecular formula C16H12N4O2S2 and molecular weight 356.04 g/mol. IUPAC: 6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-thiophen-2-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of BAS 12975747
Property Insights of BAS 12975747
The XLogP value of 3.2763 indicates that BAS 12975747 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.54 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12975747. Following Lipinski's Rule of Five, BAS 12975747 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 BAS 12975747?
The CAS number of BAS 12975747 is 878436-06-7.
What is the molecular formula of BAS 12975747?
The molecular formula of BAS 12975747 is C16H12N4O2S2.
What is the molecular weight of BAS 12975747?
The molecular weight of BAS 12975747 is 356.04 g/mol.
Where can I buy BAS 12975747?
You can request a quote for BAS 12975747 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12975747?
Yes, KEHONG BIO provides custom synthesis services for BAS 12975747 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.