BAS 03435090
TL;DR: BAS 03435090 (CAS 484681-28-9) is a chemical compound with molecular formula C20H21FN4O2S and molecular weight 400.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-ethyl-5-[(2-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(2-fluorophenyl)acetamide
Also Known As: BAS 03435090, 2-({4-ethyl-5-[(2-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-fluorophenyl)acetamide, 2-[[4-ethyl-5-[(2-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(2-fluorophenyl)acetamide
| Molecular Formula | C20H21FN4O2S |
|---|---|
| Molecular Weight | 400.14 g/mol |
| LogP | 4.05532 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 400.13693 |
| Heavy Atoms | 28 |
| Complexity | 960.88367 |
Chemical Identifiers
| CAS Number | 484681-28-9 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2F)COC3=CC=CC=C3C |
Product Overview
BAS 03435090 (CAS 484681-28-9), with molecular formula C20H21FN4O2S and molecular weight 400.14 g/mol. IUPAC: 2-[[4-ethyl-5-[(2-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(2-fluorophenyl)acetamide.
Chemical Property Profile of BAS 03435090
Property Insights of BAS 03435090
The XLogP value of 4.05532 indicates that BAS 03435090 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03435090. Following Lipinski's Rule of Five, BAS 03435090 has 1 hydrogen bond donor(s) and 5 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 03435090?
The CAS number of BAS 03435090 is 484681-28-9.
What is the molecular formula of BAS 03435090?
The molecular formula of BAS 03435090 is C20H21FN4O2S.
What is the molecular weight of BAS 03435090?
The molecular weight of BAS 03435090 is 400.14 g/mol.
Where can I buy BAS 03435090?
You can request a quote for BAS 03435090 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03435090?
Yes, KEHONG BIO provides custom synthesis services for BAS 03435090 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.