A2678/0114116
TL;DR: A2678/0114116 (CAS 442630-50-4) is a chemical compound with molecular formula C16H10Cl2N4O4S and molecular weight 423.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-nitrophenyl)acetamide
Also Known As: A2678/0114116, 2-[[5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-nitrophenyl)acetamide, 2-{[5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(3-nitrophenyl)acetamide, 2-((5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl)thio)-N-(3-nitrophenyl)acetamide
| Molecular Formula | C16H10Cl2N4O4S |
|---|---|
| Molecular Weight | 423.98 g/mol |
| LogP | 4.6824 |
| Topological Polar Surface Area | 111.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 423.97998 |
| Heavy Atoms | 27 |
| Complexity | 1011.5903 |
Chemical Identifiers
| CAS Number | 442630-50-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NN=C(O2)C3=C(C=C(C=C3)Cl)Cl |
Product Overview
A2678/0114116 (CAS 442630-50-4), with molecular formula C16H10Cl2N4O4S and molecular weight 423.98 g/mol. IUPAC: 2-[[5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-nitrophenyl)acetamide.
Chemical Property Profile of A2678/0114116
Property Insights of A2678/0114116
The XLogP value of 4.6824 indicates that A2678/0114116 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.16 Ų falls within the moderate polarity range, balancing permeability and solubility for A2678/0114116. Following Lipinski's Rule of Five, A2678/0114116 has 1 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 A2678/0114116?
The CAS number of A2678/0114116 is 442630-50-4.
What is the molecular formula of A2678/0114116?
The molecular formula of A2678/0114116 is C16H10Cl2N4O4S.
What is the molecular weight of A2678/0114116?
The molecular weight of A2678/0114116 is 423.98 g/mol.
Where can I buy A2678/0114116?
You can request a quote for A2678/0114116 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2678/0114116?
Yes, KEHONG BIO provides custom synthesis services for A2678/0114116 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.