BAS 01809470
TL;DR: BAS 01809470 (CAS 315217-52-8) is a chemical compound with molecular formula C23H19ClN6OS and molecular weight 462.10 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)-1-pyridin-4-ylethylideneamino]acetamide
Also Known As: BAS 01809470, 2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-(pyridin-4-yl)ethylidene]acetohydrazide, (E)-2-((5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(pyridin-4-yl)ethylidene)acetohydrazide, 2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio}-N'-[(E)-1-(4-pyridinyl)ethylidene]acetohydrazide, N-((1E)-2-(4-pyridyl)-1-azaprop-1-enyl)-2-[5-(4-chlorophenyl)-4-phenyl(1,2,4-t riazol-3-ylthio)]acetamide
| Molecular Formula | C23H19ClN6OS |
|---|---|
| Molecular Weight | 462.10 g/mol |
| LogP | 4.6152 |
| Topological Polar Surface Area | 85.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 462.10297 |
| Heavy Atoms | 32 |
| Complexity | 1226.6034 |
Chemical Identifiers
| CAS Number | 315217-52-8 |
|---|---|
| SMILES | C/C(=N\NC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)Cl)/C4=CC=NC=C4 |
Product Overview
BAS 01809470 (CAS 315217-52-8), with molecular formula C23H19ClN6OS and molecular weight 462.10 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-1-pyridin-4-ylethylideneamino]acetamide.
Chemical Property Profile of BAS 01809470
Property Insights of BAS 01809470
The XLogP value of 4.6152 indicates that BAS 01809470 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.06 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01809470. Following Lipinski's Rule of Five, BAS 01809470 has 1 hydrogen bond donor(s) and 6 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 01809470?
The CAS number of BAS 01809470 is 315217-52-8.
What is the molecular formula of BAS 01809470?
The molecular formula of BAS 01809470 is C23H19ClN6OS.
What is the molecular weight of BAS 01809470?
The molecular weight of BAS 01809470 is 462.10 g/mol.
Where can I buy BAS 01809470?
You can request a quote for BAS 01809470 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01809470?
Yes, KEHONG BIO provides custom synthesis services for BAS 01809470 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.