1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone
TL;DR: 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone (CAS 338755-28-5) is a chemical compound with molecular formula C13H7Cl2F3N2O3 and molecular weight 365.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dichlorophenyl)methyl]-3-nitro-5-(trifluoromethyl)pyridin-2-one
Also Known As: Bionet1_000232, DivK1c_002248, 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone, CDS1_001208, 5E-552
| Molecular Formula | C13H7Cl2F3N2O3 |
|---|---|
| Molecular Weight | 365.98 g/mol |
| LogP | 4.1304 |
| Topological Polar Surface Area | 65.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 365.97858 |
| Heavy Atoms | 23 |
| Complexity | 834.19006 |
Chemical Identifiers
| CAS Number | 338755-28-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1CN2C=C(C=C(C2=O)[N+](=O)[O-])C(F)(F)F)Cl)Cl |
Product Overview
1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone (CAS 338755-28-5), with molecular formula C13H7Cl2F3N2O3 and molecular weight 365.98 g/mol. IUPAC: 1-[(3,4-dichlorophenyl)methyl]-3-nitro-5-(trifluoromethyl)pyridin-2-one.
Chemical Property Profile of 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone
Property Insights of 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone
The XLogP value of 4.1304 indicates that 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone. Following Lipinski's Rule of Five, 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone has 0 hydrogen bond donor(s) and 3 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 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone?
The CAS number of 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone is 338755-28-5.
What is the molecular formula of 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone?
The molecular formula of 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone is C13H7Cl2F3N2O3.
What is the molecular weight of 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone?
The molecular weight of 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone is 365.98 g/mol.
Where can I buy 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone?
You can request a quote for 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-dichlorobenzyl)-3-nitro-5-(trifluoromethyl)-2(1H)-pyridinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.