![1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]- structure](/static/products/6769/67697-32-9.webp)
1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]-
TL;DR: 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]- (CAS 67697-32-9) is a chemical compound with molecular formula C20H17NO5 and molecular weight 351.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1-ethyl-2-methylindole-3-carbonyl)benzene-1,3-dicarboxylic acid
Also Known As: 4-[carbonyl]isophthalicacid, 4-[ carbonyl]isophthalicacid, 4-[(1-ethyl-2-methyl-1h-indol-3-yl)carbonyl]isophthalic acid, 4-((1-Ethyl-2-methyl-1H-indol-3-yl)carbonyl)isophthalic acid, 2-((1-Ethyl-2-methylindol-3-yl)carbonyl)-1,5-benzenedicarboxylic acid
| Molecular Formula | C20H17NO5 |
|---|---|
| Molecular Weight | 351.11 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 96.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 351.1107 |
| Heavy Atoms | 26 |
| Complexity | 577.0 |
Chemical Identifiers
| CAS Number | 67697-32-9 |
|---|---|
| SMILES | CCN1C(=C(C2=CC=CC=C21)C(=O)C3=C(C=C(C=C3)C(=O)O)C(=O)O)C |
| InChIKey | RUEPPNNHGBTSCH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]- (CAS 67697-32-9), with molecular formula C20H17NO5 and molecular weight 351.11 g/mol. IUPAC: 4-(1-ethyl-2-methylindole-3-carbonyl)benzene-1,3-dicarboxylic acid.
Chemical Property Profile of 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]-
Property Insights of 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]-
The XLogP value of 3.1 indicates that 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]-. Following Lipinski's Rule of Five, 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]- 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 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]-?
The CAS number of 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]- is 67697-32-9.
What is the molecular formula of 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]-?
The molecular formula of 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]- is C20H17NO5.
What is the molecular weight of 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]-?
The molecular weight of 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]- is 351.11 g/mol.
Where can I buy 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]-?
You can request a quote for 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.