A4091/0174407
TL;DR: A4091/0174407 (CAS 128032-39-3) is a chemical compound with molecular formula C16H10Cl2N4OS and molecular weight 376.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,4-dichlorophenyl)-6-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: A4091/0174407, 3-(2,4-dichlorophenyl)-6-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 3-(2,4-dichlorophenyl)-6-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C16H10Cl2N4OS |
|---|---|
| Molecular Weight | 376.00 g/mol |
| LogP | 4.8352 |
| Topological Polar Surface Area | 52.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.99524 |
| Heavy Atoms | 24 |
| Complexity | 1026.4232 |
Chemical Identifiers
| CAS Number | 128032-39-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN3C(=NN=C3S2)C4=C(C=C(C=C4)Cl)Cl |
Product Overview
A4091/0174407 (CAS 128032-39-3), with molecular formula C16H10Cl2N4OS and molecular weight 376.00 g/mol. IUPAC: 3-(2,4-dichlorophenyl)-6-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of A4091/0174407
Property Insights of A4091/0174407
The XLogP value of 4.8352 indicates that A4091/0174407 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.31 Ų, A4091/0174407 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A4091/0174407 has 0 hydrogen bond donor(s) and 5 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 A4091/0174407?
The CAS number of A4091/0174407 is 128032-39-3.
What is the molecular formula of A4091/0174407?
The molecular formula of A4091/0174407 is C16H10Cl2N4OS.
What is the molecular weight of A4091/0174407?
The molecular weight of A4091/0174407 is 376.00 g/mol.
Where can I buy A4091/0174407?
You can request a quote for A4091/0174407 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A4091/0174407?
Yes, KEHONG BIO provides custom synthesis services for A4091/0174407 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.