ChemDiv1_002663
TL;DR: ChemDiv1_002663 (CAS 302552-45-0) is a chemical compound with molecular formula C18H14F2N2O2S2 and molecular weight 392.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]-1-[4-(difluoromethylsulfanyl)phenyl]ethanone
Also Known As: ChemDiv1_002663, F0486-2169, 2-((5-benzyl-1,3,4-oxadiazol-2-yl)thio)-1-(4-((difluoromethyl)thio)phenyl)ethanone, 5-benzyl-2-[4-(difluoromethylthio)phenacyl]thio-1,3,4-oxadiazole, 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]-1-[4-(difluoromethylsulfanyl)phenyl]ethanone
| Molecular Formula | C18H14F2N2O2S2 |
|---|---|
| Molecular Weight | 392.05 g/mol |
| LogP | 4.9501 |
| Topological Polar Surface Area | 55.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 392.04648 |
| Heavy Atoms | 26 |
| Complexity | 855.14233 |
Chemical Identifiers
| CAS Number | 302552-45-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=NN=C(O2)SCC(=O)C3=CC=C(C=C3)SC(F)F |
Product Overview
ChemDiv1_002663 (CAS 302552-45-0), with molecular formula C18H14F2N2O2S2 and molecular weight 392.05 g/mol. IUPAC: 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]-1-[4-(difluoromethylsulfanyl)phenyl]ethanone.
Chemical Property Profile of ChemDiv1_002663
Property Insights of ChemDiv1_002663
The XLogP value of 4.9501 indicates that ChemDiv1_002663 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.99 Ų, ChemDiv1_002663 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_002663 has 0 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 ChemDiv1_002663?
The CAS number of ChemDiv1_002663 is 302552-45-0.
What is the molecular formula of ChemDiv1_002663?
The molecular formula of ChemDiv1_002663 is C18H14F2N2O2S2.
What is the molecular weight of ChemDiv1_002663?
The molecular weight of ChemDiv1_002663 is 392.05 g/mol.
Where can I buy ChemDiv1_002663?
You can request a quote for ChemDiv1_002663 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002663?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002663 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.