BAS 02617680
TL;DR: BAS 02617680 (CAS 483285-56-9) is a chemical compound with molecular formula C19H19ClN4O2S and molecular weight 402.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-[(4-chlorophenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide
Also Known As: BAS 02617680, 2-({5-[(4-chlorophenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-phenylacetamide, 2-[[5-[(4-chlorophenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide, 2-{[5-(4-chlorophenoxymethyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-phenylacetamide, 2-{5-[(4-chlorophenoxy)methyl]-4-ethyl(1,2,4-triazol-3-ylthio)}-N-phenylacetam ide
| Molecular Formula | C19H19ClN4O2S |
|---|---|
| Molecular Weight | 402.09 g/mol |
| LogP | 4.2612 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 402.09174 |
| Heavy Atoms | 27 |
| Complexity | 884.4851 |
Chemical Identifiers
| CAS Number | 483285-56-9 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2)COC3=CC=C(C=C3)Cl |
Product Overview
BAS 02617680 (CAS 483285-56-9), with molecular formula C19H19ClN4O2S and molecular weight 402.09 g/mol. IUPAC: 2-[[5-[(4-chlorophenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide.
Chemical Property Profile of BAS 02617680
Property Insights of BAS 02617680
The XLogP value of 4.2612 indicates that BAS 02617680 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 02617680. Following Lipinski's Rule of Five, BAS 02617680 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 02617680?
The CAS number of BAS 02617680 is 483285-56-9.
What is the molecular formula of BAS 02617680?
The molecular formula of BAS 02617680 is C19H19ClN4O2S.
What is the molecular weight of BAS 02617680?
The molecular weight of BAS 02617680 is 402.09 g/mol.
Where can I buy BAS 02617680?
You can request a quote for BAS 02617680 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02617680?
Yes, KEHONG BIO provides custom synthesis services for BAS 02617680 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.