N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide
TL;DR: N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide (CAS 256954-76-4) is a chemical compound with molecular formula C13H11Cl3N4O and molecular weight 344.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl]benzamide
Also Known As: N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide, N-[2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl]benzamide, N-[2,2,2-Trichloro-1-(2-pyrimidinylamino)ethyl]benzamide, N-{2,2,2-trichloro-1-[(pyrimidin-2-yl)amino]ethyl}benzamide, N1-[2,2,2-trichloro-1-(2-pyrimidinylamino)ethyl]benzamide
| Molecular Formula | C13H11Cl3N4O |
|---|---|
| Molecular Weight | 344.00 g/mol |
| LogP | 3.0148 |
| Topological Polar Surface Area | 66.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.99985 |
| Heavy Atoms | 21 |
| Complexity | 589.3703 |
Chemical Identifiers
| CAS Number | 256954-76-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)NC2=NC=CC=N2 |
Product Overview
N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide (CAS 256954-76-4), with molecular formula C13H11Cl3N4O and molecular weight 344.00 g/mol. IUPAC: N-[2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl]benzamide.
Chemical Property Profile of N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide
Property Insights of N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide
The XLogP value of 3.0148 indicates that N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.91 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide. Following Lipinski's Rule of Five, N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide has 2 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 N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide?
The CAS number of N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide is 256954-76-4.
What is the molecular formula of N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide?
The molecular formula of N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide is C13H11Cl3N4O.
What is the molecular weight of N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide?
The molecular weight of N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide is 344.00 g/mol.
Where can I buy N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide?
You can request a quote for N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.