BAS 12975325
TL;DR: BAS 12975325 (CAS 878431-48-2) is a chemical compound with molecular formula C16H14N6S and molecular weight 322.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-4-(6-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline
Also Known As: BAS 12975325, AO-365/43300987, N,N-dimethyl-4-(6-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline, N,N-dimethyl-4-(6-(pyridin-3-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline, N,N-dimethyl-4-[6-(pyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]aniline
| Molecular Formula | C16H14N6S |
|---|---|
| Molecular Weight | 322.10 g/mol |
| LogP | 2.9808 |
| Topological Polar Surface Area | 59.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.10007 |
| Heavy Atoms | 23 |
| Complexity | 939.7928 |
Chemical Identifiers
| CAS Number | 878431-48-2 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2=NN=C3N2N=C(S3)C4=CN=CC=C4 |
Product Overview
BAS 12975325 (CAS 878431-48-2), with molecular formula C16H14N6S and molecular weight 322.10 g/mol. IUPAC: N,N-dimethyl-4-(6-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)aniline.
Chemical Property Profile of BAS 12975325
Property Insights of BAS 12975325
The XLogP value of 2.9808 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12975325. With a topological polar surface area (TPSA) of 59.21 Ų, BAS 12975325 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 12975325 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 12975325?
The CAS number of BAS 12975325 is 878431-48-2.
What is the molecular formula of BAS 12975325?
The molecular formula of BAS 12975325 is C16H14N6S.
What is the molecular weight of BAS 12975325?
The molecular weight of BAS 12975325 is 322.10 g/mol.
Where can I buy BAS 12975325?
You can request a quote for BAS 12975325 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12975325?
Yes, KEHONG BIO provides custom synthesis services for BAS 12975325 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.