AN-023/42399185
TL;DR: AN-023/42399185 (CAS 485764-74-7) is a chemical compound with molecular formula C21H24N4OS2 and molecular weight 412.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-dimethylpiperidin-1-yl)-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone
Also Known As: AN-023/42399185, 1-(2,6-dimethylpiperidin-1-yl)-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone, 1-(2,6-dimethylpiperidin-1-yl)-2-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone, 2,6-dimethyl-1-({[4-phenyl-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine
| Molecular Formula | C21H24N4OS2 |
|---|---|
| Molecular Weight | 412.14 g/mol |
| LogP | 4.8774 |
| Topological Polar Surface Area | 51.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 412.13916 |
| Heavy Atoms | 28 |
| Complexity | 913.3009 |
Chemical Identifiers
| CAS Number | 485764-74-7 |
|---|---|
| SMILES | CC1CCCC(N1C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CS4)C |
Product Overview
AN-023/42399185 (CAS 485764-74-7), with molecular formula C21H24N4OS2 and molecular weight 412.14 g/mol. IUPAC: 1-(2,6-dimethylpiperidin-1-yl)-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone.
Chemical Property Profile of AN-023/42399185
Property Insights of AN-023/42399185
The XLogP value of 4.8774 indicates that AN-023/42399185 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.02 Ų, AN-023/42399185 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-023/42399185 has 0 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 AN-023/42399185?
The CAS number of AN-023/42399185 is 485764-74-7.
What is the molecular formula of AN-023/42399185?
The molecular formula of AN-023/42399185 is C21H24N4OS2.
What is the molecular weight of AN-023/42399185?
The molecular weight of AN-023/42399185 is 412.14 g/mol.
Where can I buy AN-023/42399185?
You can request a quote for AN-023/42399185 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-023/42399185?
Yes, KEHONG BIO provides custom synthesis services for AN-023/42399185 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.