Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-
TL;DR: Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- (CAS 2164-74-1) is a chemical compound with molecular formula C13H10F3N3 and molecular weight 265.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[3-(trifluoromethyl)phenyl]pyridine-3-carboximidamide
Also Known As: N-(alpha,alpha,alpha-Trifluoro-m-tolyl)nicotinamidine, 3-Pyridinecarboximidamide, N-(3-(trifluoromethyl)phenyl)-, Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-, n'-[3-(trifluoromethyl)phenyl]pyridine-3-carboximidamide, N-[3-(Trifluoromethyl)phenyl]pyridine-3-carboximidamide
| Molecular Formula | C13H10F3N3 |
|---|---|
| Molecular Weight | 265.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 51.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.08267 |
| Heavy Atoms | 19 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 2164-74-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)N=C(C2=CN=CC=C2)N)C(F)(F)F |
| InChIKey | OWXPTUNZVBFFRK-UHFFFAOYSA-N |
Product Overview
Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- (CAS 2164-74-1), with molecular formula C13H10F3N3 and molecular weight 265.08 g/mol. IUPAC: N'-[3-(trifluoromethyl)phenyl]pyridine-3-carboximidamide.
Chemical Property Profile of Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-
Property Insights of Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-. With a topological polar surface area (TPSA) of 51.3 Ų, Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- 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 Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-?
The CAS number of Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- is 2164-74-1.
What is the molecular formula of Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-?
The molecular formula of Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- is C13H10F3N3.
What is the molecular weight of Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-?
The molecular weight of Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- is 265.08 g/mol.
Where can I buy Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-?
You can request a quote for Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-?
Yes, KEHONG BIO provides custom synthesis services for Nicotinamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.