N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid
TL;DR: N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid (CAS 54871-12-4) is a chemical compound with molecular formula C19H17NO5 and molecular weight 339.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(2-hydroxybenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid
Also Known As: N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid, (1-Salicyloyl)-2-methyl-5-methoxyindolyl-3-acetic acid, 5-22-05-00245 (Beilstein Handbook Reference), Kwas(1-salicyloilo)-2-metylo-5-metoksy-3-indolilooctowy, 1-(2-Hydroxybenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetic acid
| Molecular Formula | C19H17NO5 |
|---|---|
| Molecular Weight | 339.11 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 88.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.1107 |
| Heavy Atoms | 25 |
| Complexity | 510.0 |
Chemical Identifiers
| CAS Number | 54871-12-4 |
|---|---|
| SMILES | CC1=C(C2=C(N1C(=O)C3=CC=CC=C3O)C=CC(=C2)OC)CC(=O)O |
| InChIKey | GRMRQLKCYWGDJZ-UHFFFAOYSA-N |
Product Overview
N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid (CAS 54871-12-4), with molecular formula C19H17NO5 and molecular weight 339.11 g/mol. IUPAC: 2-[1-(2-hydroxybenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid.
Chemical Property Profile of N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid
Property Insights of N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid
The XLogP value of 3.8 indicates that N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid. Following Lipinski's Rule of Five, N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid has 2 hydrogen bond donor(s) and 5 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-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid?
The CAS number of N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid is 54871-12-4.
What is the molecular formula of N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid?
The molecular formula of N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid is C19H17NO5.
What is the molecular weight of N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid?
The molecular weight of N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid is 339.11 g/mol.
Where can I buy N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid?
You can request a quote for N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid?
Yes, KEHONG BIO provides custom synthesis services for N-Salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.