A1686/0072018
TL;DR: A1686/0072018 (CAS 398471-74-4) is a chemical compound with molecular formula C26H25FN4O2S3 and molecular weight 540.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-4-[2-[3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-1,3-thiazol-4-yl]benzenesulfonamide
Also Known As: A1686/0072018, N,N-diethyl-4-[2-[3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-1,3-thiazol-4-yl]benzenesulfonamide, N,N-diethyl-4-{2-[5-(4-fluorophenyl)-3-(2-thienyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}benzenesulfonamide, N,N-diethyl-4-{2-[5-(4-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}benzenesulfonamide, N,N-DIETHYL-4-{2-[5-(4-FLUOROPHENYL)-3-(THIOPHEN-2-YL)-4,5-DIHYDRO-1H-PYRAZOL-1-YL]-1,3-THIAZOL-4-YL}BENZENE-1-SULFONAMIDE
| Molecular Formula | C26H25FN4O2S3 |
|---|---|
| Molecular Weight | 540.11 g/mol |
| LogP | 6.3969 |
| Topological Polar Surface Area | 65.87 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 540.11237 |
| Heavy Atoms | 36 |
| Complexity | 1460.3915 |
Chemical Identifiers
| CAS Number | 398471-74-4 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=CSC(=N2)N3C(CC(=N3)C4=CC=CS4)C5=CC=C(C=C5)F |
Product Overview
A1686/0072018 (CAS 398471-74-4), with molecular formula C26H25FN4O2S3 and molecular weight 540.11 g/mol. IUPAC: N,N-diethyl-4-[2-[3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-1,3-thiazol-4-yl]benzenesulfonamide.
Chemical Property Profile of A1686/0072018
Property Insights of A1686/0072018
The XLogP value of 6.3969 indicates that A1686/0072018 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.87 Ų falls within the moderate polarity range, balancing permeability and solubility for A1686/0072018. Following Lipinski's Rule of Five, A1686/0072018 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1686/0072018?
The CAS number of A1686/0072018 is 398471-74-4.
What is the molecular formula of A1686/0072018?
The molecular formula of A1686/0072018 is C26H25FN4O2S3.
What is the molecular weight of A1686/0072018?
The molecular weight of A1686/0072018 is 540.11 g/mol.
Where can I buy A1686/0072018?
You can request a quote for A1686/0072018 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1686/0072018?
Yes, KEHONG BIO provides custom synthesis services for A1686/0072018 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.