![O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide structure](/static/products/680/680210-91-7.png)
O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide
TL;DR: O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide (CAS 680210-91-7) is a chemical compound with molecular formula C13H7Cl2F3N4O2 and molecular weight 377.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-[amino-(4-chlorophenyl)methylidene]amino] 2-chloro-4-(trifluoromethyl)pyrimidine-5-carboxylate
Also Known As: O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide, [(Z)-[Amino-(4-chlorophenyl)methylidene]amino] 2-chloro-4-(trifluoromethyl)pyrimidine-5-carboxylate, [amino(4-chlorophenyl)methylidene]amino 2-chloro-4-(trifluoromethyl)pyrimidine-5-carboxylate
| Molecular Formula | C13H7Cl2F3N4O2 |
|---|---|
| Molecular Weight | 377.99 g/mol |
| LogP | 3.2795 |
| Topological Polar Surface Area | 90.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 377.9898 |
| Heavy Atoms | 24 |
| Complexity | 794.79407 |
Chemical Identifiers
| CAS Number | 680210-91-7 |
|---|---|
| SMILES | C1=CC(=CC=C1/C(=N/OC(=O)C2=CN=C(N=C2C(F)(F)F)Cl)/N)Cl |
Product Overview
O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide (CAS 680210-91-7), with molecular formula C13H7Cl2F3N4O2 and molecular weight 377.99 g/mol. IUPAC: [(Z)-[amino-(4-chlorophenyl)methylidene]amino] 2-chloro-4-(trifluoromethyl)pyrimidine-5-carboxylate.
Chemical Property Profile of O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide
Property Insights of O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide
The XLogP value of 3.2795 indicates that O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.46 Ų falls within the moderate polarity range, balancing permeability and solubility for O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide. Following Lipinski's Rule of Five, O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-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 O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide?
The CAS number of O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide is 680210-91-7.
What is the molecular formula of O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide?
The molecular formula of O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide is C13H7Cl2F3N4O2.
What is the molecular weight of O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide?
The molecular weight of O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide is 377.99 g/mol.
Where can I buy O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide?
You can request a quote for O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide?
Yes, KEHONG BIO provides custom synthesis services for O1-{[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}-4-chlorobenzene-1-carbohydroximamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.