F0529-1122
TL;DR: F0529-1122 (CAS 477215-24-0) is a chemical compound with molecular formula C16H16N6O2S4 and molecular weight 452.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-N-[5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]acetamide
Also Known As: F0529-1122, 2-(benzylsulfanyl)-N-[5-({[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]acetamide, 2-(benzylthio)-N-(5-((2-((5-methyl-1,3,4-thiadiazol-2-yl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)acetamide, 2-benzylsulfanyl-N-[5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]acetamide
| Molecular Formula | C16H16N6O2S4 |
|---|---|
| Molecular Weight | 452.02 g/mol |
| LogP | 3.30072 |
| Topological Polar Surface Area | 109.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 452.02176 |
| Heavy Atoms | 28 |
| Complexity | 930.12964 |
Chemical Identifiers
| CAS Number | 477215-24-0 |
|---|---|
| SMILES | CC1=NN=C(S1)NC(=O)CSC2=NN=C(S2)NC(=O)CSCC3=CC=CC=C3 |
Product Overview
F0529-1122 (CAS 477215-24-0), with molecular formula C16H16N6O2S4 and molecular weight 452.02 g/mol. IUPAC: 2-benzylsulfanyl-N-[5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]acetamide.
Chemical Property Profile of F0529-1122
Property Insights of F0529-1122
The XLogP value of 3.30072 indicates that F0529-1122 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.76 Ų falls within the moderate polarity range, balancing permeability and solubility for F0529-1122. Following Lipinski's Rule of Five, F0529-1122 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 F0529-1122?
The CAS number of F0529-1122 is 477215-24-0.
What is the molecular formula of F0529-1122?
The molecular formula of F0529-1122 is C16H16N6O2S4.
What is the molecular weight of F0529-1122?
The molecular weight of F0529-1122 is 452.02 g/mol.
Where can I buy F0529-1122?
You can request a quote for F0529-1122 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0529-1122?
Yes, KEHONG BIO provides custom synthesis services for F0529-1122 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.