F2645-0050
TL;DR: F2645-0050 (CAS 898443-94-2) is a chemical compound with molecular formula C18H12ClN3O2S2 and molecular weight 401.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[5-(2-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-1-benzothiophene-2-carboxamide
Also Known As: F2645-0050, 3-chloro-N-{5-[2-(methylsulfanyl)phenyl]-1,3,4-oxadiazol-2-yl}-1-benzothiophene-2-carboxamide, 3-chloro-N-(5-(2-(methylthio)phenyl)-1,3,4-oxadiazol-2-yl)benzo[b]thiophene-2-carboxamide, 3-chloro-N-[5-(2-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-1-benzothiophene-2-carboxamide, N-{5-[o-(methylthio)phenyl]-1,3,4-oxadiazol-2-yl}-3-chloro-1-benzothiophene-2-carboxamide
| Molecular Formula | C18H12ClN3O2S2 |
|---|---|
| Molecular Weight | 401.01 g/mol |
| LogP | 5.5789 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 401.00595 |
| Heavy Atoms | 26 |
| Complexity | 1106.7207 |
Chemical Identifiers
| CAS Number | 898443-94-2 |
|---|---|
| SMILES | CSC1=CC=CC=C1C2=NN=C(O2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl |
Product Overview
F2645-0050 (CAS 898443-94-2), with molecular formula C18H12ClN3O2S2 and molecular weight 401.01 g/mol. IUPAC: 3-chloro-N-[5-(2-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of F2645-0050
Property Insights of F2645-0050
The XLogP value of 5.5789 indicates that F2645-0050 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 F2645-0050. Following Lipinski's Rule of Five, F2645-0050 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F2645-0050?
The CAS number of F2645-0050 is 898443-94-2.
What is the molecular formula of F2645-0050?
The molecular formula of F2645-0050 is C18H12ClN3O2S2.
What is the molecular weight of F2645-0050?
The molecular weight of F2645-0050 is 401.01 g/mol.
Where can I buy F2645-0050?
You can request a quote for F2645-0050 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2645-0050?
Yes, KEHONG BIO provides custom synthesis services for F2645-0050 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.