2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid
TL;DR: 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid (CAS 340232-46-4) is a chemical compound with molecular formula C15H17NO4 and molecular weight 275.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,5-dimethylpyrrol-1-yl)-4,5-dimethoxybenzoic acid
Also Known As: 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid, BIM-0001232.P001, 2-(2,5-dimethylpyrrol-1-yl)-4,5-dimethoxybenzoic acid
| Molecular Formula | C15H17NO4 |
|---|---|
| Molecular Weight | 275.12 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 275.11575 |
| Heavy Atoms | 20 |
| Complexity | 339.0 |
Chemical Identifiers
| CAS Number | 340232-46-4 |
|---|---|
| SMILES | CC1=CC=C(N1C2=CC(=C(C=C2C(=O)O)OC)OC)C |
| InChIKey | HSWORBAIVIPSON-UHFFFAOYSA-N |
Product Overview
2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid (CAS 340232-46-4), with molecular formula C15H17NO4 and molecular weight 275.12 g/mol. IUPAC: 2-(2,5-dimethylpyrrol-1-yl)-4,5-dimethoxybenzoic acid.
Chemical Property Profile of 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid
Property Insights of 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid. Following Lipinski's Rule of Five, 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid has 1 hydrogen bond donor(s) and 4 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 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid?
The CAS number of 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid is 340232-46-4.
What is the molecular formula of 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid?
The molecular formula of 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid is C15H17NO4.
What is the molecular weight of 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid?
The molecular weight of 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid is 275.12 g/mol.
Where can I buy 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid?
You can request a quote for 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,5-dimethyl-1H-pyrrol-1-yl)-4,5-dimethoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.