BAS 01810781
TL;DR: BAS 01810781 (CAS 361165-64-2) is a chemical compound with molecular formula C19H21N5O2S2 and molecular weight 415.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(3-methylthiophen-2-yl)methylideneamino]acetamide
Also Known As: BAS 01810781, (E)-2-((4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)-N'-((3-methylthiophen-2-yl)methylene)acetohydrazide, 2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(3-methylthiophen-2-yl)methylideneamino]acetamide, 2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-methylthiophen-2-yl)methylidene]acetohydrazide, N-[(1E)-2-(3-methyl(2-thienyl))-1-azavinyl]-2-[4-ethyl-5-(4-methoxyphenyl)(1,2 ,4-triazol-3-ylthio)]acetamide
| Molecular Formula | C19H21N5O2S2 |
|---|---|
| Molecular Weight | 415.11 g/mol |
| LogP | 3.58592 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 415.11368 |
| Heavy Atoms | 28 |
| Complexity | 963.12177 |
Chemical Identifiers
| CAS Number | 361165-64-2 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)N/N=C/C2=C(C=CS2)C)C3=CC=C(C=C3)OC |
Product Overview
BAS 01810781 (CAS 361165-64-2), with molecular formula C19H21N5O2S2 and molecular weight 415.11 g/mol. IUPAC: 2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(3-methylthiophen-2-yl)methylideneamino]acetamide.
Chemical Property Profile of BAS 01810781
Property Insights of BAS 01810781
The XLogP value of 3.58592 indicates that BAS 01810781 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 01810781. Following Lipinski's Rule of Five, BAS 01810781 has 1 hydrogen bond donor(s) and 7 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 01810781?
The CAS number of BAS 01810781 is 361165-64-2.
What is the molecular formula of BAS 01810781?
The molecular formula of BAS 01810781 is C19H21N5O2S2.
What is the molecular weight of BAS 01810781?
The molecular weight of BAS 01810781 is 415.11 g/mol.
Where can I buy BAS 01810781?
You can request a quote for BAS 01810781 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01810781?
Yes, KEHONG BIO provides custom synthesis services for BAS 01810781 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.