F2680-0694
TL;DR: F2680-0694 (CAS 898462-30-1) is a chemical compound with molecular formula C17H23N5O2S2 and molecular weight 393.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-[(4-methylphenyl)methyl]acetamide
Also Known As: F2680-0694, 2-({5-[(tert-butylcarbamoyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-[(4-methylphenyl)methyl]acetamide, 2-((5-(3-(tert-butyl)ureido)-1,3,4-thiadiazol-2-yl)thio)-N-(4-methylbenzyl)acetamide, 2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-[(4-methylphenyl)methyl]acetamide
| Molecular Formula | C17H23N5O2S2 |
|---|---|
| Molecular Weight | 393.13 g/mol |
| LogP | 3.17502 |
| Topological Polar Surface Area | 96.01 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 393.1293 |
| Heavy Atoms | 26 |
| Complexity | 753.2589 |
Chemical Identifiers
| CAS Number | 898462-30-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC(=O)CSC2=NN=C(S2)NC(=O)NC(C)(C)C |
Product Overview
F2680-0694 (CAS 898462-30-1), with molecular formula C17H23N5O2S2 and molecular weight 393.13 g/mol. IUPAC: 2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-[(4-methylphenyl)methyl]acetamide.
Chemical Property Profile of F2680-0694
Property Insights of F2680-0694
The XLogP value of 3.17502 indicates that F2680-0694 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.01 Ų falls within the moderate polarity range, balancing permeability and solubility for F2680-0694. Following Lipinski's Rule of Five, F2680-0694 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 F2680-0694?
The CAS number of F2680-0694 is 898462-30-1.
What is the molecular formula of F2680-0694?
The molecular formula of F2680-0694 is C17H23N5O2S2.
What is the molecular weight of F2680-0694?
The molecular weight of F2680-0694 is 393.13 g/mol.
Where can I buy F2680-0694?
You can request a quote for F2680-0694 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2680-0694?
Yes, KEHONG BIO provides custom synthesis services for F2680-0694 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.