F0417-0287
TL;DR: F0417-0287 (CAS 392293-21-9) is a chemical compound with molecular formula C20H17N5O6S2 and molecular weight 487.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-[[5-[(4-nitrobenzoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: F0417-0287, ethyl 4-(2-{[5-(4-nitrobenzamido)-1,3,4-thiadiazol-2-yl]sulfanyl}acetamido)benzoate, Ethyl 4-[[2-[[5-[(4-nitrobenzoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate, ethyl 4-(2-((5-(4-nitrobenzamido)-1,3,4-thiadiazol-2-yl)thio)acetamido)benzoate
| Molecular Formula | C20H17N5O6S2 |
|---|---|
| Molecular Weight | 487.06 g/mol |
| LogP | 3.6061 |
| Topological Polar Surface Area | 153.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 487.062 |
| Heavy Atoms | 33 |
| Complexity | 1164.4482 |
Chemical Identifiers
| CAS Number | 392293-21-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
F0417-0287 (CAS 392293-21-9), with molecular formula C20H17N5O6S2 and molecular weight 487.06 g/mol. IUPAC: ethyl 4-[[2-[[5-[(4-nitrobenzoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of F0417-0287
Property Insights of F0417-0287
The XLogP value of 3.6061 indicates that F0417-0287 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 153.42 Ų indicates high polarity, suggesting F0417-0287 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0417-0287 has 2 hydrogen bond donor(s) and 10 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 F0417-0287?
The CAS number of F0417-0287 is 392293-21-9.
What is the molecular formula of F0417-0287?
The molecular formula of F0417-0287 is C20H17N5O6S2.
What is the molecular weight of F0417-0287?
The molecular weight of F0417-0287 is 487.06 g/mol.
Where can I buy F0417-0287?
You can request a quote for F0417-0287 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-0287?
Yes, KEHONG BIO provides custom synthesis services for F0417-0287 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.