BAS 06592806
TL;DR: BAS 06592806 (CAS 690961-69-4) is a chemical compound with molecular formula C18H12ClN3OS2 and molecular weight 385.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-chlorophenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl]sulfanyl]-1-phenylethanone
Also Known As: BAS 06592806, VU0618214-1, 2-{[5-(4-chlorophenyl)-[1,2,4]triazolo[3,4-b][1,3]thiazol-3-yl]sulfanyl}-1-phenylethan-1-one, F3394-0742, 2-((5-(4-chlorophenyl)thiazolo[2,3-c][1,2,4]triazol-3-yl)thio)-1-phenylethanone
| Molecular Formula | C18H12ClN3OS2 |
|---|---|
| Molecular Weight | 385.01 g/mol |
| LogP | 5.0862 |
| Topological Polar Surface Area | 47.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 385.01102 |
| Heavy Atoms | 25 |
| Complexity | 1025.6096 |
Chemical Identifiers
| CAS Number | 690961-69-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CSC2=NN=C3N2C(=CS3)C4=CC=C(C=C4)Cl |
Product Overview
BAS 06592806 (CAS 690961-69-4), with molecular formula C18H12ClN3OS2 and molecular weight 385.01 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl]sulfanyl]-1-phenylethanone.
Chemical Property Profile of BAS 06592806
Property Insights of BAS 06592806
The XLogP value of 5.0862 indicates that BAS 06592806 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.26 Ų, BAS 06592806 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 06592806 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 06592806?
The CAS number of BAS 06592806 is 690961-69-4.
What is the molecular formula of BAS 06592806?
The molecular formula of BAS 06592806 is C18H12ClN3OS2.
What is the molecular weight of BAS 06592806?
The molecular weight of BAS 06592806 is 385.01 g/mol.
Where can I buy BAS 06592806?
You can request a quote for BAS 06592806 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06592806?
Yes, KEHONG BIO provides custom synthesis services for BAS 06592806 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.