2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile
TL;DR: 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile (CAS 797769-84-7) is a chemical compound with molecular formula C18H14F9N3 and molecular weight 443.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
Also Known As: 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile, 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carbonitrile, 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
| Molecular Formula | C18H14F9N3 |
|---|---|
| Molecular Weight | 443.10 g/mol |
| LogP | 6.01428 |
| Topological Polar Surface Area | 53.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 443.1044 |
| Heavy Atoms | 30 |
| Complexity | 912.1147 |
Chemical Identifiers
| CAS Number | 797769-84-7 |
|---|---|
| SMILES | CCC1=C(C(C(=C(N1C2=CC=C(C=C2)C(F)(F)F)N)C#N)(C(F)(F)F)C(F)(F)F)C |
Product Overview
2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile (CAS 797769-84-7), with molecular formula C18H14F9N3 and molecular weight 443.10 g/mol. IUPAC: 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyridine-3-carbonitrile.
Chemical Property Profile of 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile
Property Insights of 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile
The XLogP value of 6.01428 indicates that 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.05 Ų, 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile?
The CAS number of 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile is 797769-84-7.
What is the molecular formula of 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile?
The molecular formula of 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile is C18H14F9N3.
What is the molecular weight of 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile?
The molecular weight of 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile is 443.10 g/mol.
Where can I buy 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile?
You can request a quote for 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-6-ethyl-5-methyl-4,4-bis(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,4-dihydropyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.