F0417-0064
TL;DR: F0417-0064 (CAS 392291-07-5) is a chemical compound with molecular formula C17H12ClN5O4S2 and molecular weight 449.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(2-anilino-2-oxoethyl)sulfanyl-1,3,4-thiadiazol-2-yl]-4-chloro-3-nitrobenzamide
Also Known As: F0417-0064, 4-chloro-3-nitro-N-(5-{[(phenylcarbamoyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide, N-[5-(2-anilino-2-oxoethyl)sulfanyl-1,3,4-thiadiazol-2-yl]-4-chloro-3-nitrobenzamide, 4-chloro-3-nitro-N-(5-((2-oxo-2-(phenylamino)ethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide, 4-chloro-3-nitro-N-[5-(phenylcarbamoylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide
| Molecular Formula | C17H12ClN5O4S2 |
|---|---|
| Molecular Weight | 449.00 g/mol |
| LogP | 4.0828 |
| Topological Polar Surface Area | 127.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 449.00192 |
| Heavy Atoms | 29 |
| Complexity | 1060.9866 |
Chemical Identifiers
| CAS Number | 392291-07-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-] |
Product Overview
F0417-0064 (CAS 392291-07-5), with molecular formula C17H12ClN5O4S2 and molecular weight 449.00 g/mol. IUPAC: N-[5-(2-anilino-2-oxoethyl)sulfanyl-1,3,4-thiadiazol-2-yl]-4-chloro-3-nitrobenzamide.
Chemical Property Profile of F0417-0064
Property Insights of F0417-0064
The XLogP value of 4.0828 indicates that F0417-0064 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.12 Ų falls within the moderate polarity range, balancing permeability and solubility for F0417-0064. Following Lipinski's Rule of Five, F0417-0064 has 2 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 F0417-0064?
The CAS number of F0417-0064 is 392291-07-5.
What is the molecular formula of F0417-0064?
The molecular formula of F0417-0064 is C17H12ClN5O4S2.
What is the molecular weight of F0417-0064?
The molecular weight of F0417-0064 is 449.00 g/mol.
Where can I buy F0417-0064?
You can request a quote for F0417-0064 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-0064?
Yes, KEHONG BIO provides custom synthesis services for F0417-0064 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.