BAS 12975745
TL;DR: BAS 12975745 (CAS 874466-39-4) is a chemical compound with molecular formula C15H10N4O2S2 and molecular weight 342.02 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-yl)-3-thiophen-2-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 12975745, 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-thiophen-2-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, AF-399/43300695, 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-thienyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C15H10N4O2S2 |
|---|---|
| Molecular Weight | 342.02 g/mol |
| LogP | 3.3525 |
| Topological Polar Surface Area | 61.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 342.0245 |
| Heavy Atoms | 23 |
| Complexity | 990.4265 |
Chemical Identifiers
| CAS Number | 874466-39-4 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C3=NN4C(=NN=C4S3)C5=CC=CS5 |
Product Overview
BAS 12975745 (CAS 874466-39-4), with molecular formula C15H10N4O2S2 and molecular weight 342.02 g/mol. IUPAC: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-thiophen-2-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of BAS 12975745
Property Insights of BAS 12975745
The XLogP value of 3.3525 indicates that BAS 12975745 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 12975745. Following Lipinski's Rule of Five, BAS 12975745 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 12975745?
The CAS number of BAS 12975745 is 874466-39-4.
What is the molecular formula of BAS 12975745?
The molecular formula of BAS 12975745 is C15H10N4O2S2.
What is the molecular weight of BAS 12975745?
The molecular weight of BAS 12975745 is 342.02 g/mol.
Where can I buy BAS 12975745?
You can request a quote for BAS 12975745 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12975745?
Yes, KEHONG BIO provides custom synthesis services for BAS 12975745 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.