F2680-0680
TL;DR: F2680-0680 (CAS 886940-87-0) is a chemical compound with molecular formula C16H21N5O2S2 and molecular weight 379.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide
Also Known As: F2680-0680, N-benzyl-2-({5-[(tert-butylcarbamoyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide, N-benzyl-2-((5-(3-(tert-butyl)ureido)-1,3,4-thiadiazol-2-yl)thio)acetamide, N-benzyl-2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide
| Molecular Formula | C16H21N5O2S2 |
|---|---|
| Molecular Weight | 379.11 g/mol |
| LogP | 2.8666 |
| Topological Polar Surface Area | 96.01 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 379.11368 |
| Heavy Atoms | 25 |
| Complexity | 712.8152 |
Chemical Identifiers
| CAS Number | 886940-87-0 |
|---|---|
| SMILES | CC(C)(C)NC(=O)NC1=NN=C(S1)SCC(=O)NCC2=CC=CC=C2 |
Product Overview
F2680-0680 (CAS 886940-87-0), with molecular formula C16H21N5O2S2 and molecular weight 379.11 g/mol. IUPAC: N-benzyl-2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide.
Chemical Property Profile of F2680-0680
Property Insights of F2680-0680
The XLogP value of 2.8666 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2680-0680. The TPSA of 96.01 Ų falls within the moderate polarity range, balancing permeability and solubility for F2680-0680. Following Lipinski's Rule of Five, F2680-0680 has 3 hydrogen bond donor(s) and 6 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 F2680-0680?
The CAS number of F2680-0680 is 886940-87-0.
What is the molecular formula of F2680-0680?
The molecular formula of F2680-0680 is C16H21N5O2S2.
What is the molecular weight of F2680-0680?
The molecular weight of F2680-0680 is 379.11 g/mol.
Where can I buy F2680-0680?
You can request a quote for F2680-0680 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2680-0680?
Yes, KEHONG BIO provides custom synthesis services for F2680-0680 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.