Ethyl 2-amino-4-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate
TL;DR: Ethyl 2-amino-4-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate (CAS 338400-98-9) is a chemical compound with molecular formula C17H16N2O2 and molecular weight 280.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-amino-4-naphthalen-2-yl-1H-pyrrole-3-carboxylate
Also Known As: Ethyl 2-amino-4-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate, ethyl 2-amino-4-(2-naphthyl)-1H-pyrrole-3-carboxylate, ethylaminonaphthylpyrrolecarboxylate, 3992AB, ethyl 2-amino-4-naphthalen-2-yl-1H-pyrrole-3-carboxylate
| Molecular Formula | C17H16N2O2 |
|---|---|
| Molecular Weight | 280.12 g/mol |
| LogP | 3.5938 |
| Topological Polar Surface Area | 68.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.1212 |
| Heavy Atoms | 21 |
| Complexity | 805.4103 |
Chemical Identifiers
| CAS Number | 338400-98-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC=C1C2=CC3=CC=CC=C3C=C2)N |
Product Overview
Ethyl 2-amino-4-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate (CAS 338400-98-9), with molecular formula C17H16N2O2 and molecular weight 280.12 g/mol. IUPAC: ethyl 2-amino-4-naphthalen-2-yl-1H-pyrrole-3-carboxylate.
Chemical Property Profile of Ethyl 2-amino-4-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate
Property Insights of Ethyl 2-amino-4-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate
The XLogP value of 3.5938 indicates that Ethyl 2-amino-4-(naphthalen-2-yl)-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-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-amino-4-(naphthalen-2-yl)-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-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate?
The CAS number of Ethyl 2-amino-4-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate is 338400-98-9.
What is the molecular formula of Ethyl 2-amino-4-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate?
The molecular formula of Ethyl 2-amino-4-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate is C17H16N2O2.
What is the molecular weight of Ethyl 2-amino-4-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate?
The molecular weight of Ethyl 2-amino-4-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate is 280.12 g/mol.
Where can I buy Ethyl 2-amino-4-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate?
You can request a quote for Ethyl 2-amino-4-(naphthalen-2-yl)-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-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-amino-4-(naphthalen-2-yl)-1H-pyrrole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.