Bionet1_002084
TL;DR: Bionet1_002084 (CAS 338966-60-2) is a chemical compound with molecular formula C16H10ClF3N4O3 and molecular weight 398.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[2-amino-4-(trifluoromethyl)pyrimidin-5-yl]-3-(2-chlorophenyl)-1,2-oxazole-4-carboxylate
Also Known As: Bionet1_002084, methyl 5-[2-amino-4-(trifluoromethyl)pyrimidin-5-yl]-3-(2-chlorophenyl)-1,2-oxazole-4-carboxylate, 6L-015, methyl 5-[2-amino-4-(trifluoromethyl)-5-pyrimidinyl]-3-(2-chlorophenyl)-4-isoxazolecarboxylate, methyl5-[2-amino-4-(trifluoromethyl)pyrimidin-5-yl]-3-(2-chlorophenyl)-1,2-oxazole-4-carboxylate
| Molecular Formula | C16H10ClF3N4O3 |
|---|---|
| Molecular Weight | 398.04 g/mol |
| LogP | 3.8396 |
| Topological Polar Surface Area | 104.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 398.03934 |
| Heavy Atoms | 27 |
| Complexity | 1020.3854 |
Chemical Identifiers
| CAS Number | 338966-60-2 |
|---|---|
| SMILES | COC(=O)C1=C(ON=C1C2=CC=CC=C2Cl)C3=CN=C(N=C3C(F)(F)F)N |
Product Overview
Bionet1_002084 (CAS 338966-60-2), with molecular formula C16H10ClF3N4O3 and molecular weight 398.04 g/mol. IUPAC: methyl 5-[2-amino-4-(trifluoromethyl)pyrimidin-5-yl]-3-(2-chlorophenyl)-1,2-oxazole-4-carboxylate.
Chemical Property Profile of Bionet1_002084
Property Insights of Bionet1_002084
The XLogP value of 3.8396 indicates that Bionet1_002084 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_002084. Following Lipinski's Rule of Five, Bionet1_002084 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_002084?
The CAS number of Bionet1_002084 is 338966-60-2.
What is the molecular formula of Bionet1_002084?
The molecular formula of Bionet1_002084 is C16H10ClF3N4O3.
What is the molecular weight of Bionet1_002084?
The molecular weight of Bionet1_002084 is 398.04 g/mol.
Where can I buy Bionet1_002084?
You can request a quote for Bionet1_002084 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_002084?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_002084 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.