BAS 08208996
TL;DR: BAS 08208996 (CAS 797767-66-9) is a chemical compound with molecular formula C17H14N6OS and molecular weight 350.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-methyl-5-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]pyridine-3-carboxamide
Also Known As: BAS 08208996, AP-970/42768837, N-[2-methyl-5-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]pyridine-3-carboxamide, N-[2-methyl-5-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-3-pyridinecarboxamide, N-[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]nicotinamide
| Molecular Formula | C17H14N6OS |
|---|---|
| Molecular Weight | 350.09 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.09497 |
| Heavy Atoms | 25 |
| Complexity | 494.0 |
Chemical Identifiers
| CAS Number | 797767-66-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NN3C(=NN=C3S2)C)NC(=O)C4=CN=CC=C4 |
| InChIKey | JEBPWJIDFWWMKB-UHFFFAOYSA-N |
Product Overview
BAS 08208996 (CAS 797767-66-9), with molecular formula C17H14N6OS and molecular weight 350.09 g/mol. IUPAC: N-[2-methyl-5-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]pyridine-3-carboxamide.
Chemical Property Profile of BAS 08208996
Property Insights of BAS 08208996
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 08208996. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 08208996. Following Lipinski's Rule of Five, BAS 08208996 has 1 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 08208996?
The CAS number of BAS 08208996 is 797767-66-9.
What is the molecular formula of BAS 08208996?
The molecular formula of BAS 08208996 is C17H14N6OS.
What is the molecular weight of BAS 08208996?
The molecular weight of BAS 08208996 is 350.09 g/mol.
Where can I buy BAS 08208996?
You can request a quote for BAS 08208996 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 08208996?
Yes, KEHONG BIO provides custom synthesis services for BAS 08208996 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.