BAS 03204165
TL;DR: BAS 03204165 (CAS 491645-06-8) is a chemical compound with molecular formula C19H19BrN4O2S and molecular weight 446.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)-2-[[4-ethyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 03204165, N-(4-bromophenyl)-2-{[4-ethyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(4-bromophenyl)-2-((4-ethyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(4-bromophenyl)-2-[[4-ethyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(4-bromophenyl)-2-[4-ethyl-5-(phenoxymethyl)(1,2,4-triazol-3-ylthio)]acetami de
| Molecular Formula | C19H19BrN4O2S |
|---|---|
| Molecular Weight | 446.04 g/mol |
| LogP | 4.3703 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 446.0412 |
| Heavy Atoms | 27 |
| Complexity | 884.4851 |
Chemical Identifiers
| CAS Number | 491645-06-8 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)Br)COC3=CC=CC=C3 |
Product Overview
BAS 03204165 (CAS 491645-06-8), with molecular formula C19H19BrN4O2S and molecular weight 446.04 g/mol. IUPAC: N-(4-bromophenyl)-2-[[4-ethyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 03204165
Property Insights of BAS 03204165
The XLogP value of 4.3703 indicates that BAS 03204165 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 03204165. Following Lipinski's Rule of Five, BAS 03204165 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 03204165?
The CAS number of BAS 03204165 is 491645-06-8.
What is the molecular formula of BAS 03204165?
The molecular formula of BAS 03204165 is C19H19BrN4O2S.
What is the molecular weight of BAS 03204165?
The molecular weight of BAS 03204165 is 446.04 g/mol.
Where can I buy BAS 03204165?
You can request a quote for BAS 03204165 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03204165?
Yes, KEHONG BIO provides custom synthesis services for BAS 03204165 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.