BAS 12975376
TL;DR: BAS 12975376 (CAS 878431-83-5) is a chemical compound with molecular formula C17H15N5O2S and molecular weight 353.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(3,4-dimethoxyphenyl)methyl]-3-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 12975376, 6-[(3,4-dimethoxyphenyl)methyl]-3-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, AO-365/43301014, 6-(3,4-dimethoxybenzyl)-3-(3-pyridinyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, A4092/0174449
| Molecular Formula | C17H15N5O2S |
|---|---|
| Molecular Weight | 353.09 g/mol |
| LogP | 2.8558 |
| Topological Polar Surface Area | 74.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.09464 |
| Heavy Atoms | 25 |
| Complexity | 1012.4904 |
Chemical Identifiers
| CAS Number | 878431-83-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CC2=NN3C(=NN=C3S2)C4=CN=CC=C4)OC |
Product Overview
BAS 12975376 (CAS 878431-83-5), with molecular formula C17H15N5O2S and molecular weight 353.09 g/mol. IUPAC: 6-[(3,4-dimethoxyphenyl)methyl]-3-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of BAS 12975376
Property Insights of BAS 12975376
The XLogP value of 2.8558 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12975376. The TPSA of 74.43 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12975376. Following Lipinski's Rule of Five, BAS 12975376 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 12975376?
The CAS number of BAS 12975376 is 878431-83-5.
What is the molecular formula of BAS 12975376?
The molecular formula of BAS 12975376 is C17H15N5O2S.
What is the molecular weight of BAS 12975376?
The molecular weight of BAS 12975376 is 353.09 g/mol.
Where can I buy BAS 12975376?
You can request a quote for BAS 12975376 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12975376?
Yes, KEHONG BIO provides custom synthesis services for BAS 12975376 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.