AN-023/42399413
TL;DR: AN-023/42399413 (CAS 676243-79-1) is a chemical compound with molecular formula C14H14N4OS3 and molecular weight 350.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(thiophen-2-ylmethyl)acetamide
Also Known As: AN-023/42399413, 2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(thiophen-2-ylmethyl)acetamide, 2-{[4-methyl-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]thio}-N-(2-thienylmethyl)acetamide, 2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-(thiophen-2-ylmethyl)acetamide, 2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-(2-thenyl)acetamide
| Molecular Formula | C14H14N4OS3 |
|---|---|
| Molecular Weight | 350.03 g/mol |
| LogP | 3.0136 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 350.033 |
| Heavy Atoms | 22 |
| Complexity | 734.335 |
Chemical Identifiers
| CAS Number | 676243-79-1 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NCC2=CC=CS2)C3=CC=CS3 |
Product Overview
AN-023/42399413 (CAS 676243-79-1), with molecular formula C14H14N4OS3 and molecular weight 350.03 g/mol. IUPAC: 2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(thiophen-2-ylmethyl)acetamide.
Chemical Property Profile of AN-023/42399413
Property Insights of AN-023/42399413
The XLogP value of 3.0136 indicates that AN-023/42399413 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, AN-023/42399413 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-023/42399413 has 1 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 AN-023/42399413?
The CAS number of AN-023/42399413 is 676243-79-1.
What is the molecular formula of AN-023/42399413?
The molecular formula of AN-023/42399413 is C14H14N4OS3.
What is the molecular weight of AN-023/42399413?
The molecular weight of AN-023/42399413 is 350.03 g/mol.
Where can I buy AN-023/42399413?
You can request a quote for AN-023/42399413 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-023/42399413?
Yes, KEHONG BIO provides custom synthesis services for AN-023/42399413 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.