BAS 01809495
TL;DR: BAS 01809495 (CAS 315217-75-5) is a chemical compound with molecular formula C23H17ClFN5OS and molecular weight 465.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(3-fluorophenyl)methylideneamino]acetamide
Also Known As: BAS 01809495, 2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-fluorophenyl)methylidene]acetohydrazide, (E)-2-((5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(3-fluorobenzylidene)acetohydrazide, 2-[[5-(4-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(3-fluorophenyl)methylideneamino]acetamide, N-[(1E)-2-(3-fluorophenyl)-1-azavinyl]-2-[5-(4-chlorophenyl)-4-phenyl(1,2,4-tr iazol-3-ylthio)]acetamide
| Molecular Formula | C23H17ClFN5OS |
|---|---|
| Molecular Weight | 465.08 g/mol |
| LogP | 4.9692 |
| Topological Polar Surface Area | 72.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 465.08264 |
| Heavy Atoms | 32 |
| Complexity | 1244.9987 |
Chemical Identifiers
| CAS Number | 315217-75-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N/N=C/C3=CC(=CC=C3)F)C4=CC=C(C=C4)Cl |
Product Overview
BAS 01809495 (CAS 315217-75-5), with molecular formula C23H17ClFN5OS and molecular weight 465.08 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(3-fluorophenyl)methylideneamino]acetamide.
Chemical Property Profile of BAS 01809495
Property Insights of BAS 01809495
The XLogP value of 4.9692 indicates that BAS 01809495 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.17 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01809495. Following Lipinski's Rule of Five, BAS 01809495 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 01809495?
The CAS number of BAS 01809495 is 315217-75-5.
What is the molecular formula of BAS 01809495?
The molecular formula of BAS 01809495 is C23H17ClFN5OS.
What is the molecular weight of BAS 01809495?
The molecular weight of BAS 01809495 is 465.08 g/mol.
Where can I buy BAS 01809495?
You can request a quote for BAS 01809495 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01809495?
Yes, KEHONG BIO provides custom synthesis services for BAS 01809495 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.