N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide
TL;DR: N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide (CAS 333352-72-0) is a chemical compound with molecular formula C18H16ClN3O4 and molecular weight 373.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-chlorophenyl)methyl]-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide
Also Known As: BAS 00790699, BIM-0043229.P001, N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide, N-[(2-chlorophenyl)methyl]-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide, 1-(3-Nitro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid 2-chloro-benzylamide
| Molecular Formula | C18H16ClN3O4 |
|---|---|
| Molecular Weight | 373.08 g/mol |
| LogP | 2.9175 |
| Topological Polar Surface Area | 92.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.08295 |
| Heavy Atoms | 26 |
| Complexity | 871.01965 |
Chemical Identifiers
| CAS Number | 333352-72-0 |
|---|---|
| SMILES | C1C(CN(C1=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)NCC3=CC=CC=C3Cl |
Product Overview
N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide (CAS 333352-72-0), with molecular formula C18H16ClN3O4 and molecular weight 373.08 g/mol. IUPAC: N-[(2-chlorophenyl)methyl]-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide.
Chemical Property Profile of N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide
Property Insights of N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide
The XLogP value of 2.9175 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide. The TPSA of 92.55 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide. Following Lipinski's Rule of Five, N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide has 1 hydrogen bond donor(s) and 4 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 N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide?
The CAS number of N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide is 333352-72-0.
What is the molecular formula of N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide?
The molecular formula of N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide is C18H16ClN3O4.
What is the molecular weight of N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide?
The molecular weight of N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide is 373.08 g/mol.
Where can I buy N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide?
You can request a quote for N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-chlorobenzyl)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.