A1945/0081699
TL;DR: A1945/0081699 (CAS 312510-92-2) is a chemical compound with molecular formula C23H26N4O2S and molecular weight 422.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohexyl-2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: A1945/0081699, N-cyclohexyl-2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-cyclohexyl-2-{[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-cyclohexyl-2-((5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)acetamide
| Molecular Formula | C23H26N4O2S |
|---|---|
| Molecular Weight | 422.18 g/mol |
| LogP | 4.4839 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 422.17764 |
| Heavy Atoms | 30 |
| Complexity | 966.628 |
Chemical Identifiers
| CAS Number | 312510-92-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4CCCCC4 |
Product Overview
A1945/0081699 (CAS 312510-92-2), with molecular formula C23H26N4O2S and molecular weight 422.18 g/mol. IUPAC: N-cyclohexyl-2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of A1945/0081699
Property Insights of A1945/0081699
The XLogP value of 4.4839 indicates that A1945/0081699 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for A1945/0081699. Following Lipinski's Rule of Five, A1945/0081699 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 A1945/0081699?
The CAS number of A1945/0081699 is 312510-92-2.
What is the molecular formula of A1945/0081699?
The molecular formula of A1945/0081699 is C23H26N4O2S.
What is the molecular weight of A1945/0081699?
The molecular weight of A1945/0081699 is 422.18 g/mol.
Where can I buy A1945/0081699?
You can request a quote for A1945/0081699 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1945/0081699?
Yes, KEHONG BIO provides custom synthesis services for A1945/0081699 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.