N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide
TL;DR: N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide (CAS 781-28-2) is a chemical compound with molecular formula C7H4Cl2F3N3O and molecular weight 272.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide
Also Known As: N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide, ACETAMIDE,N-(4,6-DICHLORO-5-PYRIMIDINYL)-2,2,2-TRIFLUORO-N-METHYL-, N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylaceta
| Molecular Formula | C7H4Cl2F3N3O |
|---|---|
| Molecular Weight | 272.97 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 46.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.96835 |
| Heavy Atoms | 16 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 781-28-2 |
|---|---|
| SMILES | CN(C1=C(N=CN=C1Cl)Cl)C(=O)C(F)(F)F |
| InChIKey | VDXWKMMSTUOJSH-UHFFFAOYSA-N |
Product Overview
N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide (CAS 781-28-2), with molecular formula C7H4Cl2F3N3O and molecular weight 272.97 g/mol. IUPAC: N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide.
Chemical Property Profile of N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide
Property Insights of N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide. With a topological polar surface area (TPSA) of 46.1 Ų, N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide 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 N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide?
The CAS number of N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide is 781-28-2.
What is the molecular formula of N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide?
The molecular formula of N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide is C7H4Cl2F3N3O.
What is the molecular weight of N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide?
The molecular weight of N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide is 272.97 g/mol.
Where can I buy N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide?
You can request a quote for N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4,6-dichloropyrimidin-5-yl)-2,2,2-trifluoro-N-methylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.