IFLab1_002015
TL;DR: IFLab1_002015 (CAS 389072-33-7) is a chemical compound with molecular formula C16H19FN4O2S2 and molecular weight 382.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]butanamide
Also Known As: IFLab1_002015, F0509-0280, 2-ethyl-N-(5-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)butanamide, 2-ethyl-N-[5-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]butanamide, 2-ethyl-N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]butanamide
| Molecular Formula | C16H19FN4O2S2 |
|---|---|
| Molecular Weight | 382.09 g/mol |
| LogP | 3.7827 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 382.09335 |
| Heavy Atoms | 25 |
| Complexity | 717.17975 |
Chemical Identifiers
| CAS Number | 389072-33-7 |
|---|---|
| SMILES | CCC(CC)C(=O)NC1=NN=C(S1)SCC(=O)NC2=CC=C(C=C2)F |
Product Overview
IFLab1_002015 (CAS 389072-33-7), with molecular formula C16H19FN4O2S2 and molecular weight 382.09 g/mol. IUPAC: 2-ethyl-N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]butanamide.
Chemical Property Profile of IFLab1_002015
Property Insights of IFLab1_002015
The XLogP value of 3.7827 indicates that IFLab1_002015 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.98 Ų falls within the moderate polarity range, balancing permeability and solubility for IFLab1_002015. Following Lipinski's Rule of Five, IFLab1_002015 has 2 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_002015?
The CAS number of IFLab1_002015 is 389072-33-7.
What is the molecular formula of IFLab1_002015?
The molecular formula of IFLab1_002015 is C16H19FN4O2S2.
What is the molecular weight of IFLab1_002015?
The molecular weight of IFLab1_002015 is 382.09 g/mol.
Where can I buy IFLab1_002015?
You can request a quote for IFLab1_002015 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_002015?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_002015 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.