IFLab1_002807
TL;DR: IFLab1_002807 (CAS 851131-82-3) is a chemical compound with molecular formula C17H19N5OS2 and molecular weight 373.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide
Also Known As: IFLab1_002807, 2-{[1-(3,5-dimethylphenyl)-1H-imidazol-2-yl]sulfanyl}-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide, 2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide, 2-((1-(3,5-dimethylphenyl)-1H-imidazol-2-yl)thio)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide
| Molecular Formula | C17H19N5OS2 |
|---|---|
| Molecular Weight | 373.10 g/mol |
| LogP | 3.63384 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 373.1031 |
| Heavy Atoms | 25 |
| Complexity | 866.553 |
Chemical Identifiers
| CAS Number | 851131-82-3 |
|---|---|
| SMILES | CCC1=NN=C(S1)NC(=O)CSC2=NC=CN2C3=CC(=CC(=C3)C)C |
Product Overview
IFLab1_002807 (CAS 851131-82-3), with molecular formula C17H19N5OS2 and molecular weight 373.10 g/mol. IUPAC: 2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide.
Chemical Property Profile of IFLab1_002807
Property Insights of IFLab1_002807
The XLogP value of 3.63384 indicates that IFLab1_002807 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for IFLab1_002807. Following Lipinski's Rule of Five, IFLab1_002807 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 IFLab1_002807?
The CAS number of IFLab1_002807 is 851131-82-3.
What is the molecular formula of IFLab1_002807?
The molecular formula of IFLab1_002807 is C17H19N5OS2.
What is the molecular weight of IFLab1_002807?
The molecular weight of IFLab1_002807 is 373.10 g/mol.
Where can I buy IFLab1_002807?
You can request a quote for IFLab1_002807 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_002807?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_002807 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.