N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide
TL;DR: N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide (CAS 41406-00-2) is a chemical compound with molecular formula C13H14N2O4 and molecular weight 262.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide
Also Known As: n-benzyl-n-[(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide, N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide
| Molecular Formula | C13H14N2O4 |
|---|---|
| Molecular Weight | 262.10 g/mol |
| LogP | 0.8645 |
| Topological Polar Surface Area | 78.87 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 262.09537 |
| Heavy Atoms | 19 |
| Complexity | 486.6764 |
Chemical Identifiers
| CAS Number | 41406-00-2 |
|---|---|
| SMILES | C\1C(NC(=O)/C1=C/N(CC2=CC=CC=C2)C=O)OO |
Product Overview
N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide (CAS 41406-00-2), with molecular formula C13H14N2O4 and molecular weight 262.10 g/mol. IUPAC: N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide.
Chemical Property Profile of N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide
Property Insights of N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide
The XLogP value of 0.8645 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide. The TPSA of 78.87 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide. Following Lipinski's Rule of Five, N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide has 2 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-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide?
The CAS number of N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide is 41406-00-2.
What is the molecular formula of N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide?
The molecular formula of N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide is C13H14N2O4.
What is the molecular weight of N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide?
The molecular weight of N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide is 262.10 g/mol.
Where can I buy N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide?
You can request a quote for N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-N-[(E)-(5-hydroperoxy-2-oxopyrrolidin-3-ylidene)methyl]formamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.