Bionet1_002792
TL;DR: Bionet1_002792 (CAS 318237-95-5) is a chemical compound with molecular formula C19H21F3N2O4 and molecular weight 398.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(pyrrolidine-1-carbonyl)-3-[[3-(trifluoromethyl)phenyl]carbamoyl]cyclopropane-1-carboxylate
Also Known As: Bionet1_002792, 3M-939, ethyl 2-(1-pyrrolidinylcarbonyl)-3-{[3-(trifluoromethyl)anilino]carbonyl}cyclopropanecarboxylate, ethyl 2-(pyrrolidine-1-carbonyl)-3-[[3-(trifluoromethyl)phenyl]carbamoyl]cyclopropane-1-carboxylate, ethyl 2-(pyrrolidine-1-carbonyl)-3-{[3-(trifluoromethyl)phenyl]carbamoyl}cyclopropane-1-carboxylate
| Molecular Formula | C19H21F3N2O4 |
|---|---|
| Molecular Weight | 398.15 g/mol |
| LogP | 2.6916 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.14536 |
| Heavy Atoms | 28 |
| Complexity | 774.6874 |
Chemical Identifiers
| CAS Number | 318237-95-5 |
|---|---|
| SMILES | CCOC(=O)C1C(C1C(=O)N2CCCC2)C(=O)NC3=CC=CC(=C3)C(F)(F)F |
Product Overview
Bionet1_002792 (CAS 318237-95-5), with molecular formula C19H21F3N2O4 and molecular weight 398.15 g/mol. IUPAC: ethyl 2-(pyrrolidine-1-carbonyl)-3-[[3-(trifluoromethyl)phenyl]carbamoyl]cyclopropane-1-carboxylate.
Chemical Property Profile of Bionet1_002792
Property Insights of Bionet1_002792
The XLogP value of 2.6916 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_002792. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_002792. Following Lipinski's Rule of Five, Bionet1_002792 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_002792?
The CAS number of Bionet1_002792 is 318237-95-5.
What is the molecular formula of Bionet1_002792?
The molecular formula of Bionet1_002792 is C19H21F3N2O4.
What is the molecular weight of Bionet1_002792?
The molecular weight of Bionet1_002792 is 398.15 g/mol.
Where can I buy Bionet1_002792?
You can request a quote for Bionet1_002792 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_002792?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_002792 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.