BAS 01809987
TL;DR: BAS 01809987 (CAS 315229-89-1) is a chemical compound with molecular formula C25H22FN5O2S and molecular weight 475.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-1-(4-fluorophenyl)ethylideneamino]-2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 01809987, (E)-N'-(1-(4-fluorophenyl)ethylidene)-2-((5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide, N'-[(1E)-1-(4-fluorophenyl)ethylidene]-2-{[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide, N'-[(E)-1-(4-fluorophenyl)ethylidene]-2-{[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide, N-[(1E)-2-(4-fluorophenyl)-1-azaprop-1-enyl]-2-[5-(4-methoxyphenyl)-4-phenyl(1 ,2,4-triazol-3-ylthio)]acetamide
| Molecular Formula | C25H22FN5O2S |
|---|---|
| Molecular Weight | 475.15 g/mol |
| LogP | 4.7145 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 475.14783 |
| Heavy Atoms | 34 |
| Complexity | 1289.4027 |
Chemical Identifiers
| CAS Number | 315229-89-1 |
|---|---|
| SMILES | C/C(=N\NC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)OC)/C4=CC=C(C=C4)F |
Product Overview
BAS 01809987 (CAS 315229-89-1), with molecular formula C25H22FN5O2S and molecular weight 475.15 g/mol. IUPAC: N-[(E)-1-(4-fluorophenyl)ethylideneamino]-2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 01809987
Property Insights of BAS 01809987
The XLogP value of 4.7145 indicates that BAS 01809987 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01809987. Following Lipinski's Rule of Five, BAS 01809987 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 01809987?
The CAS number of BAS 01809987 is 315229-89-1.
What is the molecular formula of BAS 01809987?
The molecular formula of BAS 01809987 is C25H22FN5O2S.
What is the molecular weight of BAS 01809987?
The molecular weight of BAS 01809987 is 475.15 g/mol.
Where can I buy BAS 01809987?
You can request a quote for BAS 01809987 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01809987?
Yes, KEHONG BIO provides custom synthesis services for BAS 01809987 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.