3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine
TL;DR: 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine (CAS 99300-77-3) is a chemical compound with molecular formula C15H16F3N3 and molecular weight 295.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-N,N,6-trimethyl-5-[[3-(trifluoromethyl)phenyl]methylidene]-4H-pyridazin-3-amine
Also Known As: PC 88, 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine, (5E)-N,N,6-trimethyl-5-[[3-(trifluoromethyl)phenyl]methylidene]-4H-pyridazin-3-amine, 3-Pyridazinamine, 4,5-dihydro-N,N,6-trimethyl-5-((3-(trifluoromethyl)phenyl)methylene)-
| Molecular Formula | C15H16F3N3 |
|---|---|
| Molecular Weight | 295.13 g/mol |
| LogP | 3.8285 |
| Topological Polar Surface Area | 27.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 295.12964 |
| Heavy Atoms | 21 |
| Complexity | 625.29614 |
Chemical Identifiers
| CAS Number | 99300-77-3 |
|---|---|
| SMILES | CC\1=NN=C(C/C1=C\C2=CC(=CC=C2)C(F)(F)F)N(C)C |
Product Overview
3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine (CAS 99300-77-3), with molecular formula C15H16F3N3 and molecular weight 295.13 g/mol. IUPAC: (5E)-N,N,6-trimethyl-5-[[3-(trifluoromethyl)phenyl]methylidene]-4H-pyridazin-3-amine.
Chemical Property Profile of 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine
Property Insights of 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine
The XLogP value of 3.8285 indicates that 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.96 Ų, 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine 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 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine?
The CAS number of 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine is 99300-77-3.
What is the molecular formula of 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine?
The molecular formula of 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine is C15H16F3N3.
What is the molecular weight of 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine?
The molecular weight of 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine is 295.13 g/mol.
Where can I buy 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine?
You can request a quote for 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine?
Yes, KEHONG BIO provides custom synthesis services for 3-Dimethylamino-5-(3'-trifluoromethyl)-6-methyl(4H)-pyridazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.