1-(4-Nitrobenzoyl)pyrrolidin-2-one
TL;DR: 1-(4-Nitrobenzoyl)pyrrolidin-2-one (CAS 119741-53-6) is a chemical compound with molecular formula C11H10N2O4 and molecular weight 234.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrobenzoyl)pyrrolidin-2-one
Also Known As: 1-(4-nitrobenzoyl)pyrrolidin-2-one, 1-{4-nitrobenzoyl}-2-pyrrolidinone, 1-(4-Nitrobenzoyl)-2-pyrrolizinone, 1-(4-nitro-benzoyl)-pyrrolidin-2-one, AF-399/15127028
| Molecular Formula | C11H10N2O4 |
|---|---|
| Molecular Weight | 234.06 g/mol |
| LogP | 1.3574 |
| Topological Polar Surface Area | 80.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.06406 |
| Heavy Atoms | 17 |
| Complexity | 480.74973 |
Chemical Identifiers
| CAS Number | 119741-53-6 |
|---|---|
| SMILES | C1CC(=O)N(C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
1-(4-Nitrobenzoyl)pyrrolidin-2-one (CAS 119741-53-6), with molecular formula C11H10N2O4 and molecular weight 234.06 g/mol. IUPAC: 1-(4-nitrobenzoyl)pyrrolidin-2-one.
Chemical Property Profile of 1-(4-Nitrobenzoyl)pyrrolidin-2-one
Property Insights of 1-(4-Nitrobenzoyl)pyrrolidin-2-one
The XLogP value of 1.3574 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Nitrobenzoyl)pyrrolidin-2-one. The TPSA of 80.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Nitrobenzoyl)pyrrolidin-2-one. Following Lipinski's Rule of Five, 1-(4-Nitrobenzoyl)pyrrolidin-2-one has 0 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 1-(4-Nitrobenzoyl)pyrrolidin-2-one?
The CAS number of 1-(4-Nitrobenzoyl)pyrrolidin-2-one is 119741-53-6.
What is the molecular formula of 1-(4-Nitrobenzoyl)pyrrolidin-2-one?
The molecular formula of 1-(4-Nitrobenzoyl)pyrrolidin-2-one is C11H10N2O4.
What is the molecular weight of 1-(4-Nitrobenzoyl)pyrrolidin-2-one?
The molecular weight of 1-(4-Nitrobenzoyl)pyrrolidin-2-one is 234.06 g/mol.
Where can I buy 1-(4-Nitrobenzoyl)pyrrolidin-2-one?
You can request a quote for 1-(4-Nitrobenzoyl)pyrrolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Nitrobenzoyl)pyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Nitrobenzoyl)pyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.