![4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid structure](/static/products/592/592550-35-1.png)
4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid
TL;DR: 4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid (CAS 592550-35-1) is a chemical compound with molecular formula C18H15NO3 and molecular weight 293.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-formyl-2-methylindol-1-yl)methyl]benzoic acid
Also Known As: Benzoicacid,4-[ methyl]-, 4-[(3-formyl-2-methylindol-1-yl)methyl]benzoic acid, 4-[(3-formyl-2-methyl-indol-1-yl)methyl]benzoic Acid, 4-[(3-formyl-2-methyl-1H-indol-1-yl)methyl]benzoic acid, Benzoic acid, 4-[(3-formyl-2-methyl-1H-indol-1-yl)methyl]- (9CI)
| Molecular Formula | C18H15NO3 |
|---|---|
| Molecular Weight | 293.11 g/mol |
| LogP | 3.50872 |
| Topological Polar Surface Area | 59.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.1052 |
| Heavy Atoms | 22 |
| Complexity | 859.9197 |
Chemical Identifiers
| CAS Number | 592550-35-1 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1CC3=CC=C(C=C3)C(=O)O)C=O |
Product Overview
4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid (CAS 592550-35-1), with molecular formula C18H15NO3 and molecular weight 293.11 g/mol. IUPAC: 4-[(3-formyl-2-methylindol-1-yl)methyl]benzoic acid.
Chemical Property Profile of 4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid
Property Insights of 4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid
The XLogP value of 3.50872 indicates that 4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.3 Ų, 4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid 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 4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid?
The CAS number of 4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid is 592550-35-1.
What is the molecular formula of 4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid?
The molecular formula of 4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid is C18H15NO3.
What is the molecular weight of 4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid?
The molecular weight of 4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid is 293.11 g/mol.
Where can I buy 4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid?
You can request a quote for 4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid 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-2-methylindol-1-yl)methyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3-Formyl-2-methylindol-1-yl)methyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.