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4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile
TL;DR: 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile (CAS 340319-18-8) is a chemical compound with molecular formula C17H12N2O and molecular weight 260.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-formylindol-1-yl)methyl]benzonitrile
Also Known As: 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile, ASISCHEM V87628, 4-[(3-formylindol-1-yl)methyl]benzonitrile, 4-(3-Formyl-indol-1-ylmethyl)-benzonitrile, BAS 06660520
| Molecular Formula | C17H12N2O |
|---|---|
| Molecular Weight | 260.09 g/mol |
| LogP | 3.37378 |
| Topological Polar Surface Area | 45.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.09497 |
| Heavy Atoms | 20 |
| Complexity | 807.11743 |
Chemical Identifiers
| CAS Number | 340319-18-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)C#N)C=O |
Product Overview
4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile (CAS 340319-18-8), with molecular formula C17H12N2O and molecular weight 260.09 g/mol. IUPAC: 4-[(3-formylindol-1-yl)methyl]benzonitrile.
Chemical Property Profile of 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile
Property Insights of 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile
The XLogP value of 3.37378 indicates that 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.79 Ų, 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile 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 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile?
The CAS number of 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile is 340319-18-8.
What is the molecular formula of 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile?
The molecular formula of 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile is C17H12N2O.
What is the molecular weight of 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile?
The molecular weight of 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile is 260.09 g/mol.
Where can I buy 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile?
You can request a quote for 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3-formyl-1H-indol-1-yl)methyl]benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.