A3756/0159243
TL;DR: A3756/0159243 (CAS 879449-11-3) is a chemical compound with molecular formula C15H16ClN5O2S and molecular weight 365.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chloro-1-ethylpyrazol-3-yl)-4-(2,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione
Also Known As: A3756/0159243, 3-(4-chloro-1-ethylpyrazol-3-yl)-4-(2,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione, 5-(4-chloro-1-ethyl-1H-pyrazol-3-yl)-4-(2,5-dimethoxyphenyl)-4H-1,2,4-triazole-3-thiol, 5-(4-chloro-1-ethyl-1H-pyrazol-3-yl)-4-(2,5-dimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione, 5-(4-CHLORO-1-ETHYL-1H-PYRAZOL-3-YL)-4-(2,5-DIMETHOXYPHENYL)-4H-1,2,4-TRIAZOL-3-YLHYDROSULFIDE
| Molecular Formula | C15H16ClN5O2S |
|---|---|
| Molecular Weight | 365.07 g/mol |
| LogP | 3.48389 |
| Topological Polar Surface Area | 69.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 365.07132 |
| Heavy Atoms | 24 |
| Complexity | 930.33514 |
Chemical Identifiers
| CAS Number | 879449-11-3 |
|---|---|
| SMILES | CCN1C=C(C(=N1)C2=NNC(=S)N2C3=C(C=CC(=C3)OC)OC)Cl |
Product Overview
A3756/0159243 (CAS 879449-11-3), with molecular formula C15H16ClN5O2S and molecular weight 365.07 g/mol. IUPAC: 3-(4-chloro-1-ethylpyrazol-3-yl)-4-(2,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of A3756/0159243
Property Insights of A3756/0159243
The XLogP value of 3.48389 indicates that A3756/0159243 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.89 Ų falls within the moderate polarity range, balancing permeability and solubility for A3756/0159243. Following Lipinski's Rule of Five, A3756/0159243 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 A3756/0159243?
The CAS number of A3756/0159243 is 879449-11-3.
What is the molecular formula of A3756/0159243?
The molecular formula of A3756/0159243 is C15H16ClN5O2S.
What is the molecular weight of A3756/0159243?
The molecular weight of A3756/0159243 is 365.07 g/mol.
Where can I buy A3756/0159243?
You can request a quote for A3756/0159243 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3756/0159243?
Yes, KEHONG BIO provides custom synthesis services for A3756/0159243 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.