N-(3-Methoxybenzylidene)aniline
TL;DR: N-(3-Methoxybenzylidene)aniline (CAS 17637-72-8) is a chemical compound with molecular formula C14H13NO and molecular weight 211.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-methoxyphenyl)-N-phenylmethanimine
Also Known As: N-(3-Methoxybenzylidene)aniline, 3-Methoxybenzylidenaniline, m-methoxybenzylideneaniline, 1-(3-methoxyphenyl)-N-phenylmethanimine, N-Phenyl-3-methoxybenzylideneamine
| Molecular Formula | C14H13NO |
|---|---|
| Molecular Weight | 211.10 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 21.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.09972 |
| Heavy Atoms | 16 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 17637-72-8 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C=NC2=CC=CC=C2 |
| InChIKey | VJHZSENXMPQTOD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(3-Methoxybenzylidene)aniline (CAS 17637-72-8), with molecular formula C14H13NO and molecular weight 211.10 g/mol. IUPAC: 1-(3-methoxyphenyl)-N-phenylmethanimine.
Chemical Property Profile of N-(3-Methoxybenzylidene)aniline
Property Insights of N-(3-Methoxybenzylidene)aniline
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-Methoxybenzylidene)aniline. With a topological polar surface area (TPSA) of 21.6 Ų, N-(3-Methoxybenzylidene)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-Methoxybenzylidene)aniline has 0 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 N-(3-Methoxybenzylidene)aniline?
The CAS number of N-(3-Methoxybenzylidene)aniline is 17637-72-8.
What is the molecular formula of N-(3-Methoxybenzylidene)aniline?
The molecular formula of N-(3-Methoxybenzylidene)aniline is C14H13NO.
What is the molecular weight of N-(3-Methoxybenzylidene)aniline?
The molecular weight of N-(3-Methoxybenzylidene)aniline is 211.10 g/mol.
Where can I buy N-(3-Methoxybenzylidene)aniline?
You can request a quote for N-(3-Methoxybenzylidene)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-Methoxybenzylidene)aniline?
Yes, KEHONG BIO provides custom synthesis services for N-(3-Methoxybenzylidene)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.