Nicotinamidine, N-(3-chloro-p-tolyl)-
TL;DR: Nicotinamidine, N-(3-chloro-p-tolyl)- (CAS 26970-82-1) is a chemical compound with molecular formula C13H12ClN3 and molecular weight 245.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(3-chloro-4-methylphenyl)pyridine-3-carboximidamide
Also Known As: N-(3-Chloro-p-tolyl)nicotinamidine, Nicotinamidine, N-(3-chloro-p-tolyl)-, 3-Pyridinecarboximidamide, N-(3-chloro-4-methylphenyl)-, n'-(3-chloro-4-methylphenyl)pyridine-3-carboximidamide, N-(3-Chloro-4-methylphenyl)pyridine-3-carboximidamide
| Molecular Formula | C13H12ClN3 |
|---|---|
| Molecular Weight | 245.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 51.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.07198 |
| Heavy Atoms | 17 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 26970-82-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N=C(C2=CN=CC=C2)N)Cl |
| InChIKey | VNNUPHBGLBVTDD-UHFFFAOYSA-N |
Product Overview
Nicotinamidine, N-(3-chloro-p-tolyl)- (CAS 26970-82-1), with molecular formula C13H12ClN3 and molecular weight 245.07 g/mol. IUPAC: N'-(3-chloro-4-methylphenyl)pyridine-3-carboximidamide.
Chemical Property Profile of Nicotinamidine, N-(3-chloro-p-tolyl)-
Property Insights of Nicotinamidine, N-(3-chloro-p-tolyl)-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nicotinamidine, N-(3-chloro-p-tolyl)-. With a topological polar surface area (TPSA) of 51.3 Ų, Nicotinamidine, N-(3-chloro-p-tolyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nicotinamidine, N-(3-chloro-p-tolyl)- has 1 hydrogen bond donor(s) and 2 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-(3-chloro-p-tolyl)-?
The CAS number of Nicotinamidine, N-(3-chloro-p-tolyl)- is 26970-82-1.
What is the molecular formula of Nicotinamidine, N-(3-chloro-p-tolyl)-?
The molecular formula of Nicotinamidine, N-(3-chloro-p-tolyl)- is C13H12ClN3.
What is the molecular weight of Nicotinamidine, N-(3-chloro-p-tolyl)-?
The molecular weight of Nicotinamidine, N-(3-chloro-p-tolyl)- is 245.07 g/mol.
Where can I buy Nicotinamidine, N-(3-chloro-p-tolyl)-?
You can request a quote for Nicotinamidine, N-(3-chloro-p-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-(3-chloro-p-tolyl)-?
Yes, KEHONG BIO provides custom synthesis services for Nicotinamidine, N-(3-chloro-p-tolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.