IFLab1_006420
TL;DR: IFLab1_006420 (CAS 620586-24-5) is a chemical compound with molecular formula C16H17N3O2S and molecular weight 315.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide
Also Known As: IFLab1_006420, 3,5-dimethyl-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1-benzofuran-2-carboxamide, AB00675647-01, AF-399/42217074, F1673-6996
| Molecular Formula | C16H17N3O2S |
|---|---|
| Molecular Weight | 315.10 g/mol |
| LogP | 4.27684 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.10416 |
| Heavy Atoms | 22 |
| Complexity | 848.3183 |
Chemical Identifiers
| CAS Number | 620586-24-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OC(=C2C)C(=O)NC3=NN=C(S3)C(C)C |
Product Overview
IFLab1_006420 (CAS 620586-24-5), with molecular formula C16H17N3O2S and molecular weight 315.10 g/mol. IUPAC: 3,5-dimethyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide.
Chemical Property Profile of IFLab1_006420
Property Insights of IFLab1_006420
The XLogP value of 4.27684 indicates that IFLab1_006420 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for IFLab1_006420. Following Lipinski's Rule of Five, IFLab1_006420 has 1 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 IFLab1_006420?
The CAS number of IFLab1_006420 is 620586-24-5.
What is the molecular formula of IFLab1_006420?
The molecular formula of IFLab1_006420 is C16H17N3O2S.
What is the molecular weight of IFLab1_006420?
The molecular weight of IFLab1_006420 is 315.10 g/mol.
Where can I buy IFLab1_006420?
You can request a quote for IFLab1_006420 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_006420?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_006420 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.