1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione
TL;DR: 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione (CAS 496772-29-3) is a chemical compound with molecular formula C15H12ClN3O2S and molecular weight 333.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-chloro-2-methylphenyl)-3-pyrimidin-2-ylsulfanylpyrrolidine-2,5-dione
Also Known As: BAS 05289223, 1-(5-chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione, 1-(5-chloro-2-methylphenyl)-3-(pyrimidin-2-ylthio)pyrrolidine-2,5-dione, 1-(5-Chloro-2-methyl-phenyl)-3-(pyrimidin-2-ylsulfanyl)-pyrrolidine-2,5-dione, 1-(5-chloro-2-methylphenyl)-3-pyrimidin-2-ylsulfanylpyrrolidine-2,5-dione
| Molecular Formula | C15H12ClN3O2S |
|---|---|
| Molecular Weight | 333.03 g/mol |
| LogP | 2.86262 |
| Topological Polar Surface Area | 63.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.03387 |
| Heavy Atoms | 22 |
| Complexity | 738.8223 |
Chemical Identifiers
| CAS Number | 496772-29-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Cl)N2C(=O)CC(C2=O)SC3=NC=CC=N3 |
Product Overview
1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione (CAS 496772-29-3), with molecular formula C15H12ClN3O2S and molecular weight 333.03 g/mol. IUPAC: 1-(5-chloro-2-methylphenyl)-3-pyrimidin-2-ylsulfanylpyrrolidine-2,5-dione.
Chemical Property Profile of 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione
Property Insights of 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione
The XLogP value of 2.86262 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione. The TPSA of 63.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione. Following Lipinski's Rule of Five, 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione 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 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione?
The CAS number of 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione is 496772-29-3.
What is the molecular formula of 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione?
The molecular formula of 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione is C15H12ClN3O2S.
What is the molecular weight of 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione?
The molecular weight of 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione is 333.03 g/mol.
Where can I buy 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione?
You can request a quote for 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)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 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Chloro-2-methylphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.