Bionet1_001063
TL;DR: Bionet1_001063 (CAS 339010-23-0) is a chemical compound with molecular formula C16H16F3N3O5 and molecular weight 387.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[2-cyano-3-[2-[3-(trifluoromethyl)phenoxy]ethoxyimino]propanoyl]carbamate
Also Known As: Bionet1_001063, ethyl N-[2-cyano-3-({2-[3-(trifluoromethyl)phenoxy]ethoxy}imino)propanoyl]carbamate, ethyl N-[2-cyano-3-[2-[3-(trifluoromethyl)phenoxy]ethoxyimino]propanoyl]carbamate
| Molecular Formula | C16H16F3N3O5 |
|---|---|
| Molecular Weight | 387.10 g/mol |
| LogP | 2.49908 |
| Topological Polar Surface Area | 110.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 387.10422 |
| Heavy Atoms | 27 |
| Complexity | 715.9878 |
Chemical Identifiers
| CAS Number | 339010-23-0 |
|---|---|
| SMILES | CCOC(=O)NC(=O)C(C=NOCCOC1=CC=CC(=C1)C(F)(F)F)C#N |
Product Overview
Bionet1_001063 (CAS 339010-23-0), with molecular formula C16H16F3N3O5 and molecular weight 387.10 g/mol. IUPAC: ethyl N-[2-cyano-3-[2-[3-(trifluoromethyl)phenoxy]ethoxyimino]propanoyl]carbamate.
Chemical Property Profile of Bionet1_001063
Property Insights of Bionet1_001063
The XLogP value of 2.49908 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_001063. The TPSA of 110.01 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_001063. Following Lipinski's Rule of Five, Bionet1_001063 has 1 hydrogen bond donor(s) and 7 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_001063?
The CAS number of Bionet1_001063 is 339010-23-0.
What is the molecular formula of Bionet1_001063?
The molecular formula of Bionet1_001063 is C16H16F3N3O5.
What is the molecular weight of Bionet1_001063?
The molecular weight of Bionet1_001063 is 387.10 g/mol.
Where can I buy Bionet1_001063?
You can request a quote for Bionet1_001063 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_001063?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_001063 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.