BAS 03435036
TL;DR: BAS 03435036 (CAS 484681-17-6) is a chemical compound with molecular formula C22H24N4O4S and molecular weight 440.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-ethyl-5-[(4-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 03435036, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-ethyl-5-[(4-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-2-(4-ethyl-5-p-tolyloxymethyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({4-ethyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-ethyl-5-[(4-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]ethanamide
| Molecular Formula | C22H24N4O4S |
|---|---|
| Molecular Weight | 440.15 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 440.15182 |
| Heavy Atoms | 31 |
| Complexity | 578.0 |
Chemical Identifiers
| CAS Number | 484681-17-6 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)OCCO3)COC4=CC=C(C=C4)C |
| InChIKey | AXDAXWMTUGIFQI-UHFFFAOYSA-N |
Product Overview
BAS 03435036 (CAS 484681-17-6), with molecular formula C22H24N4O4S and molecular weight 440.15 g/mol. IUPAC: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-ethyl-5-[(4-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 03435036
Property Insights of BAS 03435036
The XLogP value of 3.1 indicates that BAS 03435036 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03435036. Following Lipinski's Rule of Five, BAS 03435036 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 03435036?
The CAS number of BAS 03435036 is 484681-17-6.
What is the molecular formula of BAS 03435036?
The molecular formula of BAS 03435036 is C22H24N4O4S.
What is the molecular weight of BAS 03435036?
The molecular weight of BAS 03435036 is 440.15 g/mol.
Where can I buy BAS 03435036?
You can request a quote for BAS 03435036 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03435036?
Yes, KEHONG BIO provides custom synthesis services for BAS 03435036 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.