BAS 00469498
TL;DR: BAS 00469498 (CAS 329922-25-0) is a chemical compound with molecular formula C22H20N4O2S and molecular weight 404.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(furan-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylethyl)acetamide
Also Known As: BAS 00469498, 2-[[5-(furan-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylethyl)acetamide, 2-((5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N-phenethylacetamide, 2-(5-(2-furyl)-4-phenyl(1,2,4-triazol-3-ylthio))-N-(2-phenylethyl)acetamide, 2-(5-Furan-2-yl-4-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-N-phenethyl-acetamide
| Molecular Formula | C22H20N4O2S |
|---|---|
| Molecular Weight | 404.13 g/mol |
| LogP | 3.9783 |
| Topological Polar Surface Area | 72.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 404.1307 |
| Heavy Atoms | 29 |
| Complexity | 1047.1378 |
Chemical Identifiers
| CAS Number | 329922-25-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CO4 |
Product Overview
BAS 00469498 (CAS 329922-25-0), with molecular formula C22H20N4O2S and molecular weight 404.13 g/mol. IUPAC: 2-[[5-(furan-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylethyl)acetamide.
Chemical Property Profile of BAS 00469498
Property Insights of BAS 00469498
The XLogP value of 3.9783 indicates that BAS 00469498 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.95 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00469498. Following Lipinski's Rule of Five, BAS 00469498 has 1 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 BAS 00469498?
The CAS number of BAS 00469498 is 329922-25-0.
What is the molecular formula of BAS 00469498?
The molecular formula of BAS 00469498 is C22H20N4O2S.
What is the molecular weight of BAS 00469498?
The molecular weight of BAS 00469498 is 404.13 g/mol.
Where can I buy BAS 00469498?
You can request a quote for BAS 00469498 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00469498?
Yes, KEHONG BIO provides custom synthesis services for BAS 00469498 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.