Bionet1_004696
TL;DR: Bionet1_004696 (CAS 477889-90-0) is a chemical compound with molecular formula C21H26N2O3S and molecular weight 386.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-dimethylphenyl)-2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-phenylpropanamide
Also Known As: Bionet1_004696, 2R-0685, N-(3,4-dimethylphenyl)-2-(1,1-dioxo-1lambda~6~,4-thiazinan-4-yl)-3-phenylpropanamide, N-(3,4-dimethylphenyl)-2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-phenylpropanamide, N-(3,4-dimethylphenyl)-2-(1,1-dioxo-1lambda6-thiomorpholin-4-yl)-3-phenylpropanamide
| Molecular Formula | C21H26N2O3S |
|---|---|
| Molecular Weight | 386.17 g/mol |
| LogP | 2.58364 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.1664 |
| Heavy Atoms | 27 |
| Complexity | 896.2789 |
Chemical Identifiers
| CAS Number | 477889-90-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)C(CC2=CC=CC=C2)N3CCS(=O)(=O)CC3)C |
Product Overview
Bionet1_004696 (CAS 477889-90-0), with molecular formula C21H26N2O3S and molecular weight 386.17 g/mol. IUPAC: N-(3,4-dimethylphenyl)-2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-phenylpropanamide.
Chemical Property Profile of Bionet1_004696
Property Insights of Bionet1_004696
The XLogP value of 2.58364 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_004696. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_004696. Following Lipinski's Rule of Five, Bionet1_004696 has 1 hydrogen bond donor(s) and 4 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 Bionet1_004696?
The CAS number of Bionet1_004696 is 477889-90-0.
What is the molecular formula of Bionet1_004696?
The molecular formula of Bionet1_004696 is C21H26N2O3S.
What is the molecular weight of Bionet1_004696?
The molecular weight of Bionet1_004696 is 386.17 g/mol.
Where can I buy Bionet1_004696?
You can request a quote for Bionet1_004696 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_004696?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_004696 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.