IFLab1_003079
TL;DR: IFLab1_003079 (CAS 394231-76-6) is a chemical compound with molecular formula C14H14N4O2S3 and molecular weight 366.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-[5-(2-methoxyphenyl)-1,3,4-thiadiazol-2-yl]acetamide
Also Known As: IFLab1_003079, IDI1_009538, F0748-0116, 2-((4,5-dihydrothiazol-2-yl)thio)-N-(5-(2-methoxyphenyl)-1,3,4-thiadiazol-2-yl)acetamide, N-[5-(o-methoxyphenyl)-1,3,4-thiadiazol-2-yl](4,5-dihydro-1,3-thiazol-2-ylthio)acetamide
| Molecular Formula | C14H14N4O2S3 |
|---|---|
| Molecular Weight | 366.03 g/mol |
| LogP | 2.9882 |
| Topological Polar Surface Area | 76.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.0279 |
| Heavy Atoms | 23 |
| Complexity | 732.3174 |
Chemical Identifiers
| CAS Number | 394231-76-6 |
|---|---|
| SMILES | COC1=CC=CC=C1C2=NN=C(S2)NC(=O)CSC3=NCCS3 |
Product Overview
IFLab1_003079 (CAS 394231-76-6), with molecular formula C14H14N4O2S3 and molecular weight 366.03 g/mol. IUPAC: 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-[5-(2-methoxyphenyl)-1,3,4-thiadiazol-2-yl]acetamide.
Chemical Property Profile of IFLab1_003079
Property Insights of IFLab1_003079
The XLogP value of 2.9882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for IFLab1_003079. The TPSA of 76.47 Ų falls within the moderate polarity range, balancing permeability and solubility for IFLab1_003079. Following Lipinski's Rule of Five, IFLab1_003079 has 1 hydrogen bond donor(s) and 8 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_003079?
The CAS number of IFLab1_003079 is 394231-76-6.
What is the molecular formula of IFLab1_003079?
The molecular formula of IFLab1_003079 is C14H14N4O2S3.
What is the molecular weight of IFLab1_003079?
The molecular weight of IFLab1_003079 is 366.03 g/mol.
Where can I buy IFLab1_003079?
You can request a quote for IFLab1_003079 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_003079?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_003079 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.