BAS 01810644
TL;DR: BAS 01810644 (CAS 361164-80-9) is a chemical compound with molecular formula C26H25N5O2S and molecular weight 471.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]acetamide
Also Known As: BAS 01810644, N'-{(E)-[4-(benzyloxy)phenyl]methylidene}-2-[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide, 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]acetamide, N'-[(Z)-[4-(BENZYLOXY)PHENYL]METHYLIDENE]-2-[(4-ETHYL-5-PHENYL-4H-1,2,4-TRIAZOL-3-YL)SULFANYL]ACETOHYDRAZIDE, N-{(1Z)-2-[4-(phenylmethoxy)phenyl]-1-azavinyl}-2-(4-ethyl-5-phenyl(1,2,4-tria zol-3-ylthio))acetamide
| Molecular Formula | C26H25N5O2S |
|---|---|
| Molecular Weight | 471.17 g/mol |
| LogP | 4.7864 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 471.17288 |
| Heavy Atoms | 34 |
| Complexity | 1225.3077 |
Chemical Identifiers
| CAS Number | 361164-80-9 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)N/N=C\C2=CC=C(C=C2)OCC3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
BAS 01810644 (CAS 361164-80-9), with molecular formula C26H25N5O2S and molecular weight 471.17 g/mol. IUPAC: 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]acetamide.
Chemical Property Profile of BAS 01810644
Property Insights of BAS 01810644
The XLogP value of 4.7864 indicates that BAS 01810644 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 01810644. Following Lipinski's Rule of Five, BAS 01810644 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 01810644?
The CAS number of BAS 01810644 is 361164-80-9.
What is the molecular formula of BAS 01810644?
The molecular formula of BAS 01810644 is C26H25N5O2S.
What is the molecular weight of BAS 01810644?
The molecular weight of BAS 01810644 is 471.17 g/mol.
Where can I buy BAS 01810644?
You can request a quote for BAS 01810644 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01810644?
Yes, KEHONG BIO provides custom synthesis services for BAS 01810644 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.