F0417-2012
TL;DR: F0417-2012 (CAS 392317-50-9) is a chemical compound with molecular formula C20H19FN4O3S3 and molecular weight 478.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[(3-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-pyrrolidin-1-ylsulfonylbenzamide
Also Known As: F0417-2012, N-(5-{[(3-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide, N-(5-((3-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-4-(pyrrolidin-1-ylsulfonyl)benzamide, N-[5-[(3-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-pyrrolidin-1-ylsulfonylbenzamide, N-[5-[(3-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide
| Molecular Formula | C20H19FN4O3S3 |
|---|---|
| Molecular Weight | 478.06 g/mol |
| LogP | 4.0063 |
| Topological Polar Surface Area | 92.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 478.06033 |
| Heavy Atoms | 31 |
| Complexity | 1176.3905 |
Chemical Identifiers
| CAS Number | 392317-50-9 |
|---|---|
| SMILES | C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NN=C(S3)SCC4=CC(=CC=C4)F |
Product Overview
F0417-2012 (CAS 392317-50-9), with molecular formula C20H19FN4O3S3 and molecular weight 478.06 g/mol. IUPAC: N-[5-[(3-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-pyrrolidin-1-ylsulfonylbenzamide.
Chemical Property Profile of F0417-2012
Property Insights of F0417-2012
The XLogP value of 4.0063 indicates that F0417-2012 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.26 Ų falls within the moderate polarity range, balancing permeability and solubility for F0417-2012. Following Lipinski's Rule of Five, F0417-2012 has 1 hydrogen bond donor(s) and 7 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 F0417-2012?
The CAS number of F0417-2012 is 392317-50-9.
What is the molecular formula of F0417-2012?
The molecular formula of F0417-2012 is C20H19FN4O3S3.
What is the molecular weight of F0417-2012?
The molecular weight of F0417-2012 is 478.06 g/mol.
Where can I buy F0417-2012?
You can request a quote for F0417-2012 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-2012?
Yes, KEHONG BIO provides custom synthesis services for F0417-2012 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.