![1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester structure](/static/products/6992/69924-49-8.webp)
1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester
TL;DR: 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester (CAS 69924-49-8) is a chemical compound with molecular formula C22H20N4O9 and molecular weight 484.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]indole-2,3-dicarboxylate
Also Known As: 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester, 2,3-Dicarbomethoxy-1(3-(3,5-dinitrobenzoylamino)propyl)indole, dimethyl 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]indole-2,3-dicarboxylate, 1-[3-(3,5-Dinitrobenzoylamino)propyl]-1H-indole-2,3-dicarboxylic acid dimethyl ester, 2,3-dimethyl 1-{3-[(3,5-dinitrophenyl)formamido]propyl}-1H-indole-2,3-dicarboxylate
| Molecular Formula | C22H20N4O9 |
|---|---|
| Molecular Weight | 484.12 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 178.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 484.12302 |
| Heavy Atoms | 35 |
| Complexity | 805.0 |
Chemical Identifiers
| CAS Number | 69924-49-8 |
|---|---|
| SMILES | COC(=O)C1=C(N(C2=CC=CC=C21)CCCNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC |
| InChIKey | RPYNDUFRIRRTCT-UHFFFAOYSA-N |
Product Overview
1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester (CAS 69924-49-8), with molecular formula C22H20N4O9 and molecular weight 484.12 g/mol. IUPAC: dimethyl 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]indole-2,3-dicarboxylate.
Chemical Property Profile of 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester
Property Insights of 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester
The XLogP value of 3.0 indicates that 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 178.0 Ų indicates high polarity, suggesting 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester has 1 hydrogen bond donor(s) and 9 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 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester?
The CAS number of 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester is 69924-49-8.
What is the molecular formula of 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester?
The molecular formula of 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester is C22H20N4O9.
What is the molecular weight of 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester?
The molecular weight of 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester is 484.12 g/mol.
Where can I buy 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester?
You can request a quote for 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole-2,3-dicarboxylic acid, 1-[3-[(3,5-dinitrobenzoyl)amino]propyl]-, dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.