BAS 13845951
TL;DR: BAS 13845951 (CAS 878443-60-8) is a chemical compound with molecular formula C18H16N4O3S and molecular weight 368.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,5-dimethoxyphenyl)-6-(3-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 13845951, A4001/0170535, 3-(3,5-dimethoxyphenyl)-6-(3-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 3-(3,5-dimethoxyphenyl)-6-(3-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C18H16N4O3S |
|---|---|
| Molecular Weight | 368.09 g/mol |
| LogP | 3.5456 |
| Topological Polar Surface Area | 70.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.0943 |
| Heavy Atoms | 26 |
| Complexity | 1051.1818 |
Chemical Identifiers
| CAS Number | 878443-60-8 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C2=NN3C(=NN=C3S2)C4=CC(=CC(=C4)OC)OC |
Product Overview
BAS 13845951 (CAS 878443-60-8), with molecular formula C18H16N4O3S and molecular weight 368.09 g/mol. IUPAC: 3-(3,5-dimethoxyphenyl)-6-(3-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of BAS 13845951
Property Insights of BAS 13845951
The XLogP value of 3.5456 indicates that BAS 13845951 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.77 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13845951. Following Lipinski's Rule of Five, BAS 13845951 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 13845951?
The CAS number of BAS 13845951 is 878443-60-8.
What is the molecular formula of BAS 13845951?
The molecular formula of BAS 13845951 is C18H16N4O3S.
What is the molecular weight of BAS 13845951?
The molecular weight of BAS 13845951 is 368.09 g/mol.
Where can I buy BAS 13845951?
You can request a quote for BAS 13845951 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13845951?
Yes, KEHONG BIO provides custom synthesis services for BAS 13845951 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.