2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid
TL;DR: 2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid (CAS 340309-41-3) is a chemical compound with molecular formula C13H13NO3 and molecular weight 231.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,5-dimethylpyrrol-1-yl)-5-hydroxybenzoic acid
Also Known As: 2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid, BIM-0001240.P001, 2-(2,5-dimethylpyrrol-1-yl)-5-hydroxybenzoic acid, J2.311.825D, 2-(2,5-dimethylpyrrol-1-yl)-5-hydroxy-benzoic acid
| Molecular Formula | C13H13NO3 |
|---|---|
| Molecular Weight | 231.09 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 62.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.08954 |
| Heavy Atoms | 17 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 340309-41-3 |
|---|---|
| SMILES | CC1=CC=C(N1C2=C(C=C(C=C2)O)C(=O)O)C |
| InChIKey | BTNJQFIFTBDRAH-UHFFFAOYSA-N |
Product Overview
2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid (CAS 340309-41-3), with molecular formula C13H13NO3 and molecular weight 231.09 g/mol. IUPAC: 2-(2,5-dimethylpyrrol-1-yl)-5-hydroxybenzoic acid.
Chemical Property Profile of 2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid
Property Insights of 2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid. The TPSA of 62.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid. Following Lipinski's Rule of Five, 2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid has 2 hydrogen bond donor(s) and 3 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)-5-hydroxybenzoic acid?
The CAS number of 2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid is 340309-41-3.
What is the molecular formula of 2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid?
The molecular formula of 2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid is C13H13NO3.
What is the molecular weight of 2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid?
The molecular weight of 2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid is 231.09 g/mol.
Where can I buy 2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid?
You can request a quote for 2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic 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)-5-hydroxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,5-dimethyl-1H-pyrrol-1-yl)-5-hydroxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.