BAS 12975428
TL;DR: BAS 12975428 (CAS 878432-82-7) is a chemical compound with molecular formula C16H11N5O2S and molecular weight 337.06 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-3-yl)-3-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 12975428, 6-(2,3-dihydro-1,4-benzodioxin-3-yl)-3-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, AO-365/43300915, 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(3-pyridinyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C16H11N5O2S |
|---|---|
| Molecular Weight | 337.06 g/mol |
| LogP | 2.7603 |
| Topological Polar Surface Area | 74.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 337.06335 |
| Heavy Atoms | 24 |
| Complexity | 1013.67487 |
Chemical Identifiers
| CAS Number | 878432-82-7 |
|---|---|
| SMILES | C1C(OC2=CC=CC=C2O1)C3=NN4C(=NN=C4S3)C5=CN=CC=C5 |
Product Overview
BAS 12975428 (CAS 878432-82-7), with molecular formula C16H11N5O2S and molecular weight 337.06 g/mol. IUPAC: 6-(2,3-dihydro-1,4-benzodioxin-3-yl)-3-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of BAS 12975428
Property Insights of BAS 12975428
The XLogP value of 2.7603 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12975428. The TPSA of 74.43 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12975428. Following Lipinski's Rule of Five, BAS 12975428 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 12975428?
The CAS number of BAS 12975428 is 878432-82-7.
What is the molecular formula of BAS 12975428?
The molecular formula of BAS 12975428 is C16H11N5O2S.
What is the molecular weight of BAS 12975428?
The molecular weight of BAS 12975428 is 337.06 g/mol.
Where can I buy BAS 12975428?
You can request a quote for BAS 12975428 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12975428?
Yes, KEHONG BIO provides custom synthesis services for BAS 12975428 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.