BAS 12975496
TL;DR: BAS 12975496 (CAS 877806-23-0) is a chemical compound with molecular formula C15H12N4O2S and molecular weight 312.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(furan-2-yl)-6-[(4-methylphenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 12975496, 3-(furan-2-yl)-6-[(4-methylphenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, AO-365/43300808, 3-(furan-2-yl)-6-[(4-methylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, [3-(2-furyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl 4-methylphenyl ether
| Molecular Formula | C15H12N4O2S |
|---|---|
| Molecular Weight | 312.07 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 93.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.06808 |
| Heavy Atoms | 22 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 877806-23-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCC2=NN3C(=NN=C3S2)C4=CC=CO4 |
| InChIKey | JOZZIKKZNPBDGF-UHFFFAOYSA-N |
Product Overview
BAS 12975496 (CAS 877806-23-0), with molecular formula C15H12N4O2S and molecular weight 312.07 g/mol. IUPAC: 3-(furan-2-yl)-6-[(4-methylphenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of BAS 12975496
Property Insights of BAS 12975496
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12975496. The TPSA of 93.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12975496. Following Lipinski's Rule of Five, BAS 12975496 has 0 hydrogen bond donor(s) and 6 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 12975496?
The CAS number of BAS 12975496 is 877806-23-0.
What is the molecular formula of BAS 12975496?
The molecular formula of BAS 12975496 is C15H12N4O2S.
What is the molecular weight of BAS 12975496?
The molecular weight of BAS 12975496 is 312.07 g/mol.
Where can I buy BAS 12975496?
You can request a quote for BAS 12975496 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12975496?
Yes, KEHONG BIO provides custom synthesis services for BAS 12975496 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.