AR-196/42726694
TL;DR: AR-196/42726694 (CAS 708250-74-2) is a chemical compound with molecular formula C18H17BrFN5O2S2 and molecular weight 497.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide
Also Known As: AR-196/42726694, N-[[5-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide, N-[(5-{[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)methyl]-2-thiophenecarboxamide, N-{[5-({2-[(4-bromo-2-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]methyl}thiophene-2-carboxamide
| Molecular Formula | C18H17BrFN5O2S2 |
|---|---|
| Molecular Weight | 497.00 g/mol |
| LogP | 3.9219 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 496.9991 |
| Heavy Atoms | 29 |
| Complexity | 1009.85754 |
Chemical Identifiers
| CAS Number | 708250-74-2 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)Br)F)CNC(=O)C3=CC=CS3 |
Product Overview
AR-196/42726694 (CAS 708250-74-2), with molecular formula C18H17BrFN5O2S2 and molecular weight 497.00 g/mol. IUPAC: N-[[5-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide.
Chemical Property Profile of AR-196/42726694
Property Insights of AR-196/42726694
The XLogP value of 3.9219 indicates that AR-196/42726694 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.91 Ų falls within the moderate polarity range, balancing permeability and solubility for AR-196/42726694. Following Lipinski's Rule of Five, AR-196/42726694 has 2 hydrogen bond donor(s) and 6 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 AR-196/42726694?
The CAS number of AR-196/42726694 is 708250-74-2.
What is the molecular formula of AR-196/42726694?
The molecular formula of AR-196/42726694 is C18H17BrFN5O2S2.
What is the molecular weight of AR-196/42726694?
The molecular weight of AR-196/42726694 is 497.00 g/mol.
Where can I buy AR-196/42726694?
You can request a quote for AR-196/42726694 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AR-196/42726694?
Yes, KEHONG BIO provides custom synthesis services for AR-196/42726694 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.