A3874/0164625
TL;DR: A3874/0164625 (CAS 728032-46-0) is a chemical compound with molecular formula C21H22ClN3O3 and molecular weight 399.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-chlorophenyl)methyl]-3-[4-(2-hydroxyphenyl)piperazin-1-yl]pyrrolidine-2,5-dione
Also Known As: A3874/0164625, 1-[(4-chlorophenyl)methyl]-3-[4-(2-hydroxyphenyl)piperazin-1-yl]pyrrolidine-2,5-dione, 1-(4-chlorobenzyl)-3-[4-(2-hydroxyphenyl)piperazin-1-yl]pyrrolidine-2,5-dione, 1-(4-CHLOROBENZYL)-3-[4-(2-HYDROXYPHENYL)PIPERAZINO]DIHYDRO-1H-PYRROLE-2,5-DIONE
| Molecular Formula | C21H22ClN3O3 |
|---|---|
| Molecular Weight | 399.13 g/mol |
| LogP | 2.4953 |
| Topological Polar Surface Area | 64.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.13498 |
| Heavy Atoms | 28 |
| Complexity | 878.7195 |
Chemical Identifiers
| CAS Number | 728032-46-0 |
|---|---|
| SMILES | C1CN(CCN1C2CC(=O)N(C2=O)CC3=CC=C(C=C3)Cl)C4=CC=CC=C4O |
Product Overview
A3874/0164625 (CAS 728032-46-0), with molecular formula C21H22ClN3O3 and molecular weight 399.13 g/mol. IUPAC: 1-[(4-chlorophenyl)methyl]-3-[4-(2-hydroxyphenyl)piperazin-1-yl]pyrrolidine-2,5-dione.
Chemical Property Profile of A3874/0164625
Property Insights of A3874/0164625
The XLogP value of 2.4953 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3874/0164625. The TPSA of 64.09 Ų falls within the moderate polarity range, balancing permeability and solubility for A3874/0164625. Following Lipinski's Rule of Five, A3874/0164625 has 1 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 A3874/0164625?
The CAS number of A3874/0164625 is 728032-46-0.
What is the molecular formula of A3874/0164625?
The molecular formula of A3874/0164625 is C21H22ClN3O3.
What is the molecular weight of A3874/0164625?
The molecular weight of A3874/0164625 is 399.13 g/mol.
Where can I buy A3874/0164625?
You can request a quote for A3874/0164625 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3874/0164625?
Yes, KEHONG BIO provides custom synthesis services for A3874/0164625 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.