Bionet1_002790
TL;DR: Bionet1_002790 (CAS 318237-93-3) is a chemical compound with molecular formula C15H13ClF3N3O4 and molecular weight 391.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-methylamino]-2,4-dioxo-3-azabicyclo[3.1.0]hexane-6-carboxylate
Also Known As: Bionet1_002790, ethyl 3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-2,4-dioxo-3-azabicyclo[3.1.0]hexane-6-carboxylate, 3M-937, ethyl 3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl](methyl)amino}-2,4-dioxo-3-azabicyclo[3.1.0]hexane-6-carboxylate, ethyl 3-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-methylamino]-2,4-dioxo-3-azabicyclo[3.1.0]hexane-6-carboxylate
| Molecular Formula | C15H13ClF3N3O4 |
|---|---|
| Molecular Weight | 391.05 g/mol |
| LogP | 1.8991 |
| Topological Polar Surface Area | 79.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.05466 |
| Heavy Atoms | 26 |
| Complexity | 778.83154 |
Chemical Identifiers
| CAS Number | 318237-93-3 |
|---|---|
| SMILES | CCOC(=O)C1C2C1C(=O)N(C2=O)N(C)C3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
Bionet1_002790 (CAS 318237-93-3), with molecular formula C15H13ClF3N3O4 and molecular weight 391.05 g/mol. IUPAC: ethyl 3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-methylamino]-2,4-dioxo-3-azabicyclo[3.1.0]hexane-6-carboxylate.
Chemical Property Profile of Bionet1_002790
Property Insights of Bionet1_002790
The XLogP value of 1.8991 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_002790. The TPSA of 79.81 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_002790. Following Lipinski's Rule of Five, Bionet1_002790 has 0 hydrogen bond donor(s) and 6 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_002790?
The CAS number of Bionet1_002790 is 318237-93-3.
What is the molecular formula of Bionet1_002790?
The molecular formula of Bionet1_002790 is C15H13ClF3N3O4.
What is the molecular weight of Bionet1_002790?
The molecular weight of Bionet1_002790 is 391.05 g/mol.
Where can I buy Bionet1_002790?
You can request a quote for Bionet1_002790 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_002790?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_002790 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.