4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid
TL;DR: 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid (CAS 886496-70-4) is a chemical compound with molecular formula C13H10Cl2N2O3 and molecular weight 312.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3,4-dichlorobenzoyl)amino]-1-methylpyrrole-2-carboxylic acid
Also Known As: 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid, 4-(3,4-Dichlorobenzamido)-1-methyl-1H-pyrrole-2-carboxylic acid, 4-[(3,4-dichlorobenzoyl)amino]-1-methylpyrrole-2-carboxylic acid, 4-[(3,4-dichlorobenzoyl)amino]-1-methyl-pyrrole-2-carboxylic Acid, 4-(3,4-dichloro-benzoylamino)-1-methyl-1h-pyrrole-2-carboxylic acid
| Molecular Formula | C13H10Cl2N2O3 |
|---|---|
| Molecular Weight | 312.01 g/mol |
| LogP | 3.2824 |
| Topological Polar Surface Area | 71.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.00684 |
| Heavy Atoms | 20 |
| Complexity | 694.91986 |
Chemical Identifiers
| CAS Number | 886496-70-4 |
|---|---|
| SMILES | CN1C=C(C=C1C(=O)O)NC(=O)C2=CC(=C(C=C2)Cl)Cl |
Product Overview
4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid (CAS 886496-70-4), with molecular formula C13H10Cl2N2O3 and molecular weight 312.01 g/mol. IUPAC: 4-[(3,4-dichlorobenzoyl)amino]-1-methylpyrrole-2-carboxylic acid.
Chemical Property Profile of 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid
Property Insights of 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid
The XLogP value of 3.2824 indicates that 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid. Following Lipinski's Rule of Five, 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid has 2 hydrogen bond donor(s) and 2 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 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid?
The CAS number of 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid is 886496-70-4.
What is the molecular formula of 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid?
The molecular formula of 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid is C13H10Cl2N2O3.
What is the molecular weight of 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid?
The molecular weight of 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid is 312.01 g/mol.
Where can I buy 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid?
You can request a quote for 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(3,4-Dichloro-benzoylamino)-1-methyl-1H-pyrrole--2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.