ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate
TL;DR: ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate (CAS 338968-27-7) is a chemical compound with molecular formula C13H12Cl2N2O2 and molecular weight 298.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate
Also Known As: ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate
| Molecular Formula | C13H12Cl2N2O2 |
|---|---|
| Molecular Weight | 298.03 g/mol |
| LogP | 3.7474 |
| Topological Polar Surface Area | 68.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.0276 |
| Heavy Atoms | 19 |
| Complexity | 623.10095 |
Chemical Identifiers
| CAS Number | 338968-27-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC=C1C2=CC(=C(C=C2)Cl)Cl)N |
Product Overview
ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate (CAS 338968-27-7), with molecular formula C13H12Cl2N2O2 and molecular weight 298.03 g/mol. IUPAC: ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate.
Chemical Property Profile of ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate
Property Insights of ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate
The XLogP value of 3.7474 indicates that ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.11 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate. Following Lipinski's Rule of Five, ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate 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 ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate?
The CAS number of ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate is 338968-27-7.
What is the molecular formula of ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate?
The molecular formula of ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate is C13H12Cl2N2O2.
What is the molecular weight of ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate?
The molecular weight of ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate is 298.03 g/mol.
Where can I buy ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate?
You can request a quote for ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-amino-4-(3,4-dichlorophenyl)-1H-pyrrole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.