3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one
TL;DR: 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one (CAS 339111-04-5) is a chemical compound with molecular formula C16H16N4O2 and molecular weight 296.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one
Also Known As: 3-(phenylmethoxyiminomethyl)-1-pyrimidin-2-yl-pyrrolidin-2-one, 3-(phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one, 2-oxo-1-(2-pyrimidinyl)-3-pyrrolidinecarbaldehyde O-benzyloxime, 3-{[(benzyloxy)imino]methyl}-1-(pyrimidin-2-yl)pyrrolidin-2-one
| Molecular Formula | C16H16N4O2 |
|---|---|
| Molecular Weight | 296.13 g/mol |
| LogP | 2.0321 |
| Topological Polar Surface Area | 67.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.12732 |
| Heavy Atoms | 22 |
| Complexity | 645.7101 |
Chemical Identifiers
| CAS Number | 339111-04-5 |
|---|---|
| SMILES | C1CN(C(=O)C1C=NOCC2=CC=CC=C2)C3=NC=CC=N3 |
Product Overview
3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one (CAS 339111-04-5), with molecular formula C16H16N4O2 and molecular weight 296.13 g/mol. IUPAC: 3-(phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one.
Chemical Property Profile of 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one
Property Insights of 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one
The XLogP value of 2.0321 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one. The TPSA of 67.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one. Following Lipinski's Rule of Five, 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one has 0 hydrogen bond donor(s) and 5 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 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one?
The CAS number of 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one is 339111-04-5.
What is the molecular formula of 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one?
The molecular formula of 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one is C16H16N4O2.
What is the molecular weight of 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one?
The molecular weight of 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one is 296.13 g/mol.
Where can I buy 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one?
You can request a quote for 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(Phenylmethoxyiminomethyl)-1-pyrimidin-2-ylpyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.