BAS 06402029
TL;DR: BAS 06402029 (CAS 392296-81-0) is a chemical compound with molecular formula C16H17F3N4O2S2 and molecular weight 418.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyl-N-[5-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide
Also Known As: BAS 06402029, F0417-0742, N-(5-((2-oxo-2-((2-(trifluoromethyl)phenyl)amino)ethyl)thio)-1,3,4-thiadiazol-2-yl)pivalamide, 2,2-dimethyl-N-[5-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide, 2,2-dimethyl-N-{5-[({[2-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide
| Molecular Formula | C16H17F3N4O2S2 |
|---|---|
| Molecular Weight | 418.07 g/mol |
| LogP | 4.2723 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.0745 |
| Heavy Atoms | 27 |
| Complexity | 831.5582 |
Chemical Identifiers
| CAS Number | 392296-81-0 |
|---|---|
| SMILES | CC(C)(C)C(=O)NC1=NN=C(S1)SCC(=O)NC2=CC=CC=C2C(F)(F)F |
Product Overview
BAS 06402029 (CAS 392296-81-0), with molecular formula C16H17F3N4O2S2 and molecular weight 418.07 g/mol. IUPAC: 2,2-dimethyl-N-[5-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide.
Chemical Property Profile of BAS 06402029
Property Insights of BAS 06402029
The XLogP value of 4.2723 indicates that BAS 06402029 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.98 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06402029. Following Lipinski's Rule of Five, BAS 06402029 has 2 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 BAS 06402029?
The CAS number of BAS 06402029 is 392296-81-0.
What is the molecular formula of BAS 06402029?
The molecular formula of BAS 06402029 is C16H17F3N4O2S2.
What is the molecular weight of BAS 06402029?
The molecular weight of BAS 06402029 is 418.07 g/mol.
Where can I buy BAS 06402029?
You can request a quote for BAS 06402029 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06402029?
Yes, KEHONG BIO provides custom synthesis services for BAS 06402029 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.