(2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate
TL;DR: (2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate (CAS 721907-57-9) is a chemical compound with molecular formula C15H19N3O5 and molecular weight 321.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate
Also Known As: (2-oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate, 2-oxo-2-(pyrrolidin-1-yl)ethyl 4-(ethylamino)-3-nitrobenzoate
| Molecular Formula | C15H19N3O5 |
|---|---|
| Molecular Weight | 321.13 g/mol |
| LogP | 1.8058 |
| Topological Polar Surface Area | 101.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 321.13248 |
| Heavy Atoms | 23 |
| Complexity | 611.12994 |
Chemical Identifiers
| CAS Number | 721907-57-9 |
|---|---|
| SMILES | CCNC1=C(C=C(C=C1)C(=O)OCC(=O)N2CCCC2)[N+](=O)[O-] |
Product Overview
(2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate (CAS 721907-57-9), with molecular formula C15H19N3O5 and molecular weight 321.13 g/mol. IUPAC: (2-oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate.
Chemical Property Profile of (2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate
Property Insights of (2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate
The XLogP value of 1.8058 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate. The TPSA of 101.78 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate. Following Lipinski's Rule of Five, (2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate has 1 hydrogen bond donor(s) and 6 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-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate?
The CAS number of (2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate is 721907-57-9.
What is the molecular formula of (2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate?
The molecular formula of (2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate is C15H19N3O5.
What is the molecular weight of (2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate?
The molecular weight of (2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate is 321.13 g/mol.
Where can I buy (2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate?
You can request a quote for (2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for (2-Oxo-2-pyrrolidin-1-ylethyl) 4-(ethylamino)-3-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.