![O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide structure](/static/products/655/655235-04-4.png)
O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide
TL;DR: O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide (CAS 655235-04-4) is a chemical compound with molecular formula C13H8ClF3N4O2 and molecular weight 344.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-[amino-(3-chloropyrazin-2-yl)methylidene]amino] 3-(trifluoromethyl)benzoate
Also Known As: O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide, O2-[3-(Trifluoromethyl)benzoyl]-3-chloropyrazine-2-carboximidamide, [amino(3-chloropyrazin-2-yl)methylidene]amino 3-(trifluoromethyl)benzoate, [(Z)-[Amino-(3-chloropyrazin-2-yl)methylidene]amino] 3-(trifluoromethyl)benzoate
| Molecular Formula | C13H8ClF3N4O2 |
|---|---|
| Molecular Weight | 344.03 g/mol |
| LogP | 2.6261 |
| Topological Polar Surface Area | 90.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.02878 |
| Heavy Atoms | 23 |
| Complexity | 764.88 |
Chemical Identifiers
| CAS Number | 655235-04-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C(=O)O/N=C(/C2=NC=CN=C2Cl)\N |
Product Overview
O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide (CAS 655235-04-4), with molecular formula C13H8ClF3N4O2 and molecular weight 344.03 g/mol. IUPAC: [(Z)-[amino-(3-chloropyrazin-2-yl)methylidene]amino] 3-(trifluoromethyl)benzoate.
Chemical Property Profile of O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide
Property Insights of O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide
The XLogP value of 2.6261 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide. The TPSA of 90.46 Ų falls within the moderate polarity range, balancing permeability and solubility for O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide. Following Lipinski's Rule of Five, O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide has 1 hydrogen bond donor(s) and 5 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 O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide?
The CAS number of O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide is 655235-04-4.
What is the molecular formula of O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide?
The molecular formula of O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide is C13H8ClF3N4O2.
What is the molecular weight of O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide?
The molecular weight of O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide is 344.03 g/mol.
Where can I buy O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide?
You can request a quote for O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide?
Yes, KEHONG BIO provides custom synthesis services for O2-[3-(trifluoromethyl)benzoyl]-3-chloropyrazine-2-carbohydroximamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.