4-Methoxy-2-(3-toluidino)nicotinonitrile
TL;DR: 4-Methoxy-2-(3-toluidino)nicotinonitrile (CAS 341966-96-9) is a chemical compound with molecular formula C14H13N3O and molecular weight 239.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-2-(3-methylanilino)pyridine-3-carbonitrile
Also Known As: 4-methoxy-2-(3-toluidino)nicotinonitrile, 4-methoxy-2-(3-methylanilino)pyridine-3-carbonitrile, 4-methoxy-2-[(3-methylphenyl)amino]pyridine-3-carbonitrile
| Molecular Formula | C14H13N3O |
|---|---|
| Molecular Weight | 239.11 g/mol |
| LogP | 3.0139 |
| Topological Polar Surface Area | 57.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 239.10587 |
| Heavy Atoms | 18 |
| Complexity | 602.2284 |
Chemical Identifiers
| CAS Number | 341966-96-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC2=NC=CC(=C2C#N)OC |
Product Overview
4-Methoxy-2-(3-toluidino)nicotinonitrile (CAS 341966-96-9), with molecular formula C14H13N3O and molecular weight 239.11 g/mol. IUPAC: 4-methoxy-2-(3-methylanilino)pyridine-3-carbonitrile.
Chemical Property Profile of 4-Methoxy-2-(3-toluidino)nicotinonitrile
Property Insights of 4-Methoxy-2-(3-toluidino)nicotinonitrile
The XLogP value of 3.0139 indicates that 4-Methoxy-2-(3-toluidino)nicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.94 Ų, 4-Methoxy-2-(3-toluidino)nicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxy-2-(3-toluidino)nicotinonitrile has 1 hydrogen bond donor(s) and 4 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-Methoxy-2-(3-toluidino)nicotinonitrile?
The CAS number of 4-Methoxy-2-(3-toluidino)nicotinonitrile is 341966-96-9.
What is the molecular formula of 4-Methoxy-2-(3-toluidino)nicotinonitrile?
The molecular formula of 4-Methoxy-2-(3-toluidino)nicotinonitrile is C14H13N3O.
What is the molecular weight of 4-Methoxy-2-(3-toluidino)nicotinonitrile?
The molecular weight of 4-Methoxy-2-(3-toluidino)nicotinonitrile is 239.11 g/mol.
Where can I buy 4-Methoxy-2-(3-toluidino)nicotinonitrile?
You can request a quote for 4-Methoxy-2-(3-toluidino)nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-2-(3-toluidino)nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-2-(3-toluidino)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.