BAS 10123139
TL;DR: BAS 10123139 (CAS 799782-90-4) is a chemical compound with molecular formula C19H18N4O3S and molecular weight 382.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methylphenyl)-6-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 10123139, 3-(4-methylphenyl)-6-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 3-(4-methylphenyl)-6-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, AP-501/41329075, 3-(p-tolyl)-6-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C19H18N4O3S |
|---|---|
| Molecular Weight | 382.11 g/mol |
| LogP | 3.85402 |
| Topological Polar Surface Area | 70.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.10995 |
| Heavy Atoms | 27 |
| Complexity | 1077.046 |
Chemical Identifiers
| CAS Number | 799782-90-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN=C3N2N=C(S3)C4=CC(=C(C(=C4)OC)OC)OC |
Product Overview
BAS 10123139 (CAS 799782-90-4), with molecular formula C19H18N4O3S and molecular weight 382.11 g/mol. IUPAC: 3-(4-methylphenyl)-6-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of BAS 10123139
Property Insights of BAS 10123139
The XLogP value of 3.85402 indicates that BAS 10123139 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 10123139. Following Lipinski's Rule of Five, BAS 10123139 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 10123139?
The CAS number of BAS 10123139 is 799782-90-4.
What is the molecular formula of BAS 10123139?
The molecular formula of BAS 10123139 is C19H18N4O3S.
What is the molecular weight of BAS 10123139?
The molecular weight of BAS 10123139 is 382.11 g/mol.
Where can I buy BAS 10123139?
You can request a quote for BAS 10123139 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10123139?
Yes, KEHONG BIO provides custom synthesis services for BAS 10123139 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.