F0417-2093
TL;DR: F0417-2093 (CAS 392318-72-8) is a chemical compound with molecular formula C17H20N4O5S3 and molecular weight 456.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[5-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate
Also Known As: F0417-2093, ethyl 2-((5-(4-(pyrrolidin-1-ylsulfonyl)benzamido)-1,3,4-thiadiazol-2-yl)thio)acetate, ethyl 2-({5-[4-(pyrrolidine-1-sulfonyl)benzamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate, Ethyl 2-[[5-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate
| Molecular Formula | C17H20N4O5S3 |
|---|---|
| Molecular Weight | 456.06 g/mol |
| LogP | 2.2301 |
| Topological Polar Surface Area | 118.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 456.05957 |
| Heavy Atoms | 29 |
| Complexity | 969.20953 |
Chemical Identifiers
| CAS Number | 392318-72-8 |
|---|---|
| SMILES | CCOC(=O)CSC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3 |
Product Overview
F0417-2093 (CAS 392318-72-8), with molecular formula C17H20N4O5S3 and molecular weight 456.06 g/mol. IUPAC: ethyl 2-[[5-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate.
Chemical Property Profile of F0417-2093
Property Insights of F0417-2093
The XLogP value of 2.2301 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0417-2093. The TPSA of 118.56 Ų falls within the moderate polarity range, balancing permeability and solubility for F0417-2093. Following Lipinski's Rule of Five, F0417-2093 has 1 hydrogen bond donor(s) and 9 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 F0417-2093?
The CAS number of F0417-2093 is 392318-72-8.
What is the molecular formula of F0417-2093?
The molecular formula of F0417-2093 is C17H20N4O5S3.
What is the molecular weight of F0417-2093?
The molecular weight of F0417-2093 is 456.06 g/mol.
Where can I buy F0417-2093?
You can request a quote for F0417-2093 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-2093?
Yes, KEHONG BIO provides custom synthesis services for F0417-2093 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.