N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline
TL;DR: N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline (CAS 300804-58-4) is a chemical compound with molecular formula C17H16N2 and molecular weight 248.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,5-dimethylphenyl)-1-(1H-indol-3-yl)methanimine
Also Known As: N-(1H-indol-3-ylmethylene)-2,5-dimethylaniline, N-(indol-3-ylidenemethyl)-2,5-dimethylaniline, N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline, N-[(E)-indol-3-ylidenemethyl]-2,5-dimethylaniline, N-[(Z)-indol-3-ylidenemethyl]-2,5-dimethylaniline
| Molecular Formula | C17H16N2 |
|---|---|
| Molecular Weight | 248.13 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.13135 |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 300804-58-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)N=CC2=CNC3=CC=CC=C32 |
| InChIKey | PFROVLAYVAJYHF-UHFFFAOYSA-N |
Product Overview
N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline (CAS 300804-58-4), with molecular formula C17H16N2 and molecular weight 248.13 g/mol. IUPAC: N-(2,5-dimethylphenyl)-1-(1H-indol-3-yl)methanimine.
Chemical Property Profile of N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline
Property Insights of N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline
The XLogP value of 4.2 indicates that N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline has 1 hydrogen bond donor(s) and 1 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-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline?
The CAS number of N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline is 300804-58-4.
What is the molecular formula of N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline?
The molecular formula of N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline is C17H16N2.
What is the molecular weight of N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline?
The molecular weight of N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline is 248.13 g/mol.
Where can I buy N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline?
You can request a quote for N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[(E)-1H-indol-3-ylmethylidene]-2,5-dimethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.