Bionet2_001291
TL;DR: Bionet2_001291 (CAS 478047-14-2) is a chemical compound with molecular formula C22H23F3N2O2S and molecular weight 436.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[1-[[4-(trifluoromethyl)phenyl]methyl]indol-3-yl]ethyl]-1,4-thiazinane 1,1-dioxide
Also Known As: Bionet2_001291, NPE546, 4-(2-{1-[4-(trifluoromethyl)benzyl]-1H-indol-3-yl}ethyl)-1lambda~6~,4-thiazinane-1,1-dione, 4R-0625, 4-[2-[1-[[4-(trifluoromethyl)phenyl]methyl]indol-3-yl]ethyl]-1,4-thiazinane 1,1-dioxide
| Molecular Formula | C22H23F3N2O2S |
|---|---|
| Molecular Weight | 436.14 g/mol |
| LogP | 3.9813 |
| Topological Polar Surface Area | 42.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 436.14322 |
| Heavy Atoms | 30 |
| Complexity | 1121.3942 |
Chemical Identifiers
| CAS Number | 478047-14-2 |
|---|---|
| SMILES | C1CS(=O)(=O)CCN1CCC2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)C(F)(F)F |
Product Overview
Bionet2_001291 (CAS 478047-14-2), with molecular formula C22H23F3N2O2S and molecular weight 436.14 g/mol. IUPAC: 4-[2-[1-[[4-(trifluoromethyl)phenyl]methyl]indol-3-yl]ethyl]-1,4-thiazinane 1,1-dioxide.
Chemical Property Profile of Bionet2_001291
Property Insights of Bionet2_001291
The XLogP value of 3.9813 indicates that Bionet2_001291 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.31 Ų, Bionet2_001291 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet2_001291 has 0 hydrogen bond donor(s) and 3 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 Bionet2_001291?
The CAS number of Bionet2_001291 is 478047-14-2.
What is the molecular formula of Bionet2_001291?
The molecular formula of Bionet2_001291 is C22H23F3N2O2S.
What is the molecular weight of Bionet2_001291?
The molecular weight of Bionet2_001291 is 436.14 g/mol.
Where can I buy Bionet2_001291?
You can request a quote for Bionet2_001291 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet2_001291?
Yes, KEHONG BIO provides custom synthesis services for Bionet2_001291 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.