Bionet1_003849
TL;DR: Bionet1_003849 (CAS 477888-03-2) is a chemical compound with molecular formula C16H11Cl2F3N2O2 and molecular weight 390.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(4-chloroanilino)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]prop-2-enoate
Also Known As: Bionet1_003849, methyl (Z)-3-(4-chloroanilino)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-propenoate, methyl 3-(4-chloroanilino)-2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]prop-2-enoate
| Molecular Formula | C16H11Cl2F3N2O2 |
|---|---|
| Molecular Weight | 390.01 g/mol |
| LogP | 5.0332 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.01495 |
| Heavy Atoms | 25 |
| Complexity | 806.0174 |
Chemical Identifiers
| CAS Number | 477888-03-2 |
|---|---|
| SMILES | COC(=O)C(=CNC1=CC=C(C=C1)Cl)C2=C(C=C(C=N2)C(F)(F)F)Cl |
Product Overview
Bionet1_003849 (CAS 477888-03-2), with molecular formula C16H11Cl2F3N2O2 and molecular weight 390.01 g/mol. IUPAC: methyl 3-(4-chloroanilino)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]prop-2-enoate.
Chemical Property Profile of Bionet1_003849
Property Insights of Bionet1_003849
The XLogP value of 5.0332 indicates that Bionet1_003849 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, Bionet1_003849 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_003849 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bionet1_003849?
The CAS number of Bionet1_003849 is 477888-03-2.
What is the molecular formula of Bionet1_003849?
The molecular formula of Bionet1_003849 is C16H11Cl2F3N2O2.
What is the molecular weight of Bionet1_003849?
The molecular weight of Bionet1_003849 is 390.01 g/mol.
Where can I buy Bionet1_003849?
You can request a quote for Bionet1_003849 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_003849?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_003849 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.