BAS 08863854
TL;DR: BAS 08863854 (CAS 709003-79-2) is a chemical compound with molecular formula C20H25N5O2S2 and molecular weight 431.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-ethyl-5-[1-(4-ethylphenoxy)ethyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
Also Known As: BAS 08863854, 2-({4-ethyl-5-[1-(4-ethylphenoxy)ethyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide, 2-[[4-ethyl-5-[1-(4-ethylphenoxy)ethyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
| Molecular Formula | C20H25N5O2S2 |
|---|---|
| Molecular Weight | 431.14 g/mol |
| LogP | 4.49612 |
| Topological Polar Surface Area | 81.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 431.14496 |
| Heavy Atoms | 29 |
| Complexity | 952.1947 |
Chemical Identifiers
| CAS Number | 709003-79-2 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)OC(C)C2=NN=C(N2CC)SCC(=O)NC3=NC(=CS3)C |
Product Overview
BAS 08863854 (CAS 709003-79-2), with molecular formula C20H25N5O2S2 and molecular weight 431.14 g/mol. IUPAC: 2-[[4-ethyl-5-[1-(4-ethylphenoxy)ethyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide.
Chemical Property Profile of BAS 08863854
Property Insights of BAS 08863854
The XLogP value of 4.49612 indicates that BAS 08863854 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.93 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 08863854. Following Lipinski's Rule of Five, BAS 08863854 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 08863854?
The CAS number of BAS 08863854 is 709003-79-2.
What is the molecular formula of BAS 08863854?
The molecular formula of BAS 08863854 is C20H25N5O2S2.
What is the molecular weight of BAS 08863854?
The molecular weight of BAS 08863854 is 431.14 g/mol.
Where can I buy BAS 08863854?
You can request a quote for BAS 08863854 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 08863854?
Yes, KEHONG BIO provides custom synthesis services for BAS 08863854 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.