RefChem:422846
TL;DR: RefChem:422846 (CAS 477333-49-6) is a chemical compound with molecular formula C25H24N4O4S and molecular weight 476.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dimethoxyphenyl)-2-[[4-(4-ethoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone
Also Known As: 1-(3,4-Dimethoxyphenyl)-2-((4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)thio)ethanone, 1-(3,4-dimethoxyphenyl)-2-[[4-(4-ethoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone, 1-(3,4-dimethoxyphenyl)-2-{[4-(4-ethoxyphenyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone, 1-(3,4-DIMETHOXYPHENYL)-2-((4-(4-ETHOXYPHENYL)-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL)SULFANYL)ETHANONE, 1-(3,4-dimethoxyphenyl)-2-{[4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
| Molecular Formula | C25H24N4O4S |
|---|---|
| Molecular Weight | 476.15 g/mol |
| LogP | 4.7202 |
| Topological Polar Surface Area | 88.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 476.15182 |
| Heavy Atoms | 34 |
| Complexity | 1259.9131 |
Chemical Identifiers
| CAS Number | 477333-49-6 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC(=C(C=C3)OC)OC)C4=CN=CC=C4 |
Product Overview
RefChem:422846 (CAS 477333-49-6), with molecular formula C25H24N4O4S and molecular weight 476.15 g/mol. IUPAC: 1-(3,4-dimethoxyphenyl)-2-[[4-(4-ethoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone.
Chemical Property Profile of RefChem:422846
Property Insights of RefChem:422846
The XLogP value of 4.7202 indicates that RefChem:422846 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.36 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:422846. Following Lipinski's Rule of Five, RefChem:422846 has 0 hydrogen bond donor(s) and 8 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 RefChem:422846?
The CAS number of RefChem:422846 is 477333-49-6.
What is the molecular formula of RefChem:422846?
The molecular formula of RefChem:422846 is C25H24N4O4S.
What is the molecular weight of RefChem:422846?
The molecular weight of RefChem:422846 is 476.15 g/mol.
Where can I buy RefChem:422846?
You can request a quote for RefChem:422846 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:422846?
Yes, KEHONG BIO provides custom synthesis services for RefChem:422846 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.