3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione
TL;DR: 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione (CAS 696648-45-0) is a chemical compound with molecular formula C17H16ClN3O2 and molecular weight 329.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-chlorophenyl)methyl]-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione
Also Known As: BAS 07869303, A3482/0147703, 3-(4-chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione, 3-(4-Chloro-benzyl)-1-(4,6-dimethyl-pyrimidin-2-yl)-pyrrolidine-2,5-dione, 3-[(4-chlorophenyl)methyl]-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione
| Molecular Formula | C17H16ClN3O2 |
|---|---|
| Molecular Weight | 329.09 g/mol |
| LogP | 2.86904 |
| Topological Polar Surface Area | 63.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.0931 |
| Heavy Atoms | 23 |
| Complexity | 753.65796 |
Chemical Identifiers
| CAS Number | 696648-45-0 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)N2C(=O)CC(C2=O)CC3=CC=C(C=C3)Cl)C |
Product Overview
3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione (CAS 696648-45-0), with molecular formula C17H16ClN3O2 and molecular weight 329.09 g/mol. IUPAC: 3-[(4-chlorophenyl)methyl]-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione.
Chemical Property Profile of 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione
Property Insights of 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione
The XLogP value of 2.86904 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione. The TPSA of 63.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione. Following Lipinski's Rule of Five, 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione 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 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione?
The CAS number of 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione is 696648-45-0.
What is the molecular formula of 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione?
The molecular formula of 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione is C17H16ClN3O2.
What is the molecular weight of 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione?
The molecular weight of 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione is 329.09 g/mol.
Where can I buy 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione?
You can request a quote for 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorobenzyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidine-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.