AP-970/42165875
TL;DR: AP-970/42165875 (CAS 708994-58-5) is a chemical compound with molecular formula C23H28FN5O3S and molecular weight 473.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-2-[4-[[[3-[(2-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]amino]methyl]-2-methoxyphenoxy]acetamide
Also Known As: AP-970/42165875, N-(tert-butyl)-2-{4-[({3-[(2-fluorobenzyl)thio]-4H-1,2,4-triazol-4-yl}amino)methyl]-2-methoxyphenoxy}acetamide, N-tert-butyl-2-[4-[[[3-[(2-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]amino]methyl]-2-methoxyphenoxy]acetamide, N-tert-Butyl-2-(4-{[3-(2-fluoro-benzylsulfanyl)-[1,2,4]triazol-4-ylamino]-methyl}-2-methoxy-phenoxy)-acetamide, N-tert-butyl-2-{4-[({3-[(2-fluorobenzyl)sulfanyl]-4H-1,2,4-triazol-4-yl}amino)methyl]-2-methoxyphenoxy}acetamide
| Molecular Formula | C23H28FN5O3S |
|---|---|
| Molecular Weight | 473.19 g/mol |
| LogP | 3.7553 |
| Topological Polar Surface Area | 90.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 473.1897 |
| Heavy Atoms | 33 |
| Complexity | 1083.954 |
Chemical Identifiers
| CAS Number | 708994-58-5 |
|---|---|
| SMILES | CC(C)(C)NC(=O)COC1=C(C=C(C=C1)CNN2C=NN=C2SCC3=CC=CC=C3F)OC |
Product Overview
AP-970/42165875 (CAS 708994-58-5), with molecular formula C23H28FN5O3S and molecular weight 473.19 g/mol. IUPAC: N-tert-butyl-2-[4-[[[3-[(2-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]amino]methyl]-2-methoxyphenoxy]acetamide.
Chemical Property Profile of AP-970/42165875
Property Insights of AP-970/42165875
The XLogP value of 3.7553 indicates that AP-970/42165875 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.3 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-970/42165875. Following Lipinski's Rule of Five, AP-970/42165875 has 2 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 AP-970/42165875?
The CAS number of AP-970/42165875 is 708994-58-5.
What is the molecular formula of AP-970/42165875?
The molecular formula of AP-970/42165875 is C23H28FN5O3S.
What is the molecular weight of AP-970/42165875?
The molecular weight of AP-970/42165875 is 473.19 g/mol.
Where can I buy AP-970/42165875?
You can request a quote for AP-970/42165875 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42165875?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42165875 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.