Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl-
TL;DR: Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl- (CAS 69236-56-2) is a chemical compound with molecular formula C13H14F3N3O5 and molecular weight 349.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propylpropanamide
Also Known As: Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl-, Urea, N-(2,5-dimethoxyphenethyl)-N-methyl-, N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propylpropanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl-propanamide, RefChem:374154
| Molecular Formula | C13H14F3N3O5 |
|---|---|
| Molecular Weight | 349.09 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 349.08856 |
| Heavy Atoms | 24 |
| Complexity | 465.0 |
Chemical Identifiers
| CAS Number | 69236-56-2 |
|---|---|
| SMILES | CCCN(C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])C(=O)CC |
| InChIKey | VFTBFWNODJPOJT-UHFFFAOYSA-N |
Product Overview
Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl- (CAS 69236-56-2), with molecular formula C13H14F3N3O5 and molecular weight 349.09 g/mol. IUPAC: N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propylpropanamide.
Chemical Property Profile of Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl-
Property Insights of Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl-
The XLogP value of 3.2 indicates that Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl-. Following Lipinski's Rule of Five, Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl- has 0 hydrogen bond donor(s) and 8 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 Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl-?
The CAS number of Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl- is 69236-56-2.
What is the molecular formula of Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl-?
The molecular formula of Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl- is C13H14F3N3O5.
What is the molecular weight of Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl-?
The molecular weight of Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl- is 349.09 g/mol.
Where can I buy Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl-?
You can request a quote for Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl-?
Yes, KEHONG BIO provides custom synthesis services for Propanamide, N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-propyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.