AL-281/14777002
TL;DR: AL-281/14777002 (CAS 354550-14-4) is a chemical compound with molecular formula C19H19BrN2O2S2 and molecular weight 450.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-bromo-4-methoxyphenyl)methylsulfanyl]-5-[(4-ethoxyphenyl)methyl]-1,3,4-thiadiazole
Also Known As: AL-281/14777002, 2-[(3-bromo-4-methoxyphenyl)methylsulfanyl]-5-[(4-ethoxyphenyl)methyl]-1,3,4-thiadiazole, 2-[(3-bromo-4-methoxybenzyl)sulfanyl]-5-(4-ethoxybenzyl)-1,3,4-thiadiazole, 5-(3-bromo-4-methoxybenzyl)mercapto-2-(4-ethoxybenzyl)-1,3,4-thiadiazole
| Molecular Formula | C19H19BrN2O2S2 |
|---|---|
| Molecular Weight | 450.01 g/mol |
| LogP | 5.591 |
| Topological Polar Surface Area | 44.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 450.00714 |
| Heavy Atoms | 26 |
| Complexity | 853.00037 |
Chemical Identifiers
| CAS Number | 354550-14-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)CC2=NN=C(S2)SCC3=CC(=C(C=C3)OC)Br |
Product Overview
AL-281/14777002 (CAS 354550-14-4), with molecular formula C19H19BrN2O2S2 and molecular weight 450.01 g/mol. IUPAC: 2-[(3-bromo-4-methoxyphenyl)methylsulfanyl]-5-[(4-ethoxyphenyl)methyl]-1,3,4-thiadiazole.
Chemical Property Profile of AL-281/14777002
Property Insights of AL-281/14777002
The XLogP value of 5.591 indicates that AL-281/14777002 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.24 Ų, AL-281/14777002 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AL-281/14777002 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AL-281/14777002?
The CAS number of AL-281/14777002 is 354550-14-4.
What is the molecular formula of AL-281/14777002?
The molecular formula of AL-281/14777002 is C19H19BrN2O2S2.
What is the molecular weight of AL-281/14777002?
The molecular weight of AL-281/14777002 is 450.01 g/mol.
Where can I buy AL-281/14777002?
You can request a quote for AL-281/14777002 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AL-281/14777002?
Yes, KEHONG BIO provides custom synthesis services for AL-281/14777002 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.