4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile
TL;DR: 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile (CAS 370071-97-9) is a chemical compound with molecular formula C16H13F3N4O2 and molecular weight 350.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile
Also Known As: 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile, 4,6-dimethyl-5-nitro-2-((3-(trifluoromethyl)benzyl)amino)nicotinonitrile, 4,6-dimethyl-5-nitro-2-{[3-(trifluoromethyl)benzyl]amino}pyridine-3-carbonitrile
| Molecular Formula | C16H13F3N4O2 |
|---|---|
| Molecular Weight | 350.10 g/mol |
| LogP | 4.10922 |
| Topological Polar Surface Area | 91.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.09906 |
| Heavy Atoms | 25 |
| Complexity | 872.9043 |
Chemical Identifiers
| CAS Number | 370071-97-9 |
|---|---|
| SMILES | CC1=C(C(=NC(=C1[N+](=O)[O-])C)NCC2=CC(=CC=C2)C(F)(F)F)C#N |
Product Overview
4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile (CAS 370071-97-9), with molecular formula C16H13F3N4O2 and molecular weight 350.10 g/mol. IUPAC: 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile.
Chemical Property Profile of 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile
Property Insights of 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile
The XLogP value of 4.10922 indicates that 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile. Following Lipinski's Rule of Five, 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile 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 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile?
The CAS number of 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile is 370071-97-9.
What is the molecular formula of 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile?
The molecular formula of 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile is C16H13F3N4O2.
What is the molecular weight of 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile?
The molecular weight of 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile is 350.10 g/mol.
Where can I buy 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile?
You can request a quote for 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4,6-dimethyl-5-nitro-2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.