A2976/0125419
TL;DR: A2976/0125419 (CAS 522649-66-7) is a chemical compound with molecular formula C22H24ClN3O3 and molecular weight 413.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-1-(3-methoxyphenyl)pyrrolidine-2,5-dione
Also Known As: A2976/0125419, 3-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-1-(3-methoxyphenyl)pyrrolidine-2,5-dione, 3-(4-(2-chlorobenzyl)piperazin-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione, 3-[4-(2-chlorobenzyl)piperazin-1-yl]-1-(3-methoxyphenyl)pyrrolidine-2,5-dione, 3-[4-(2-CHLOROBENZYL)PIPERAZINO]-1-(3-METHOXYPHENYL)DIHYDRO-1H-PYRROLE-2,5-DIONE
| Molecular Formula | C22H24ClN3O3 |
|---|---|
| Molecular Weight | 413.15 g/mol |
| LogP | 2.7983 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.1506 |
| Heavy Atoms | 29 |
| Complexity | 911.6804 |
Chemical Identifiers
| CAS Number | 522649-66-7 |
|---|---|
| SMILES | COC1=CC=CC(=C1)N2C(=O)CC(C2=O)N3CCN(CC3)CC4=CC=CC=C4Cl |
Product Overview
A2976/0125419 (CAS 522649-66-7), with molecular formula C22H24ClN3O3 and molecular weight 413.15 g/mol. IUPAC: 3-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-1-(3-methoxyphenyl)pyrrolidine-2,5-dione.
Chemical Property Profile of A2976/0125419
Property Insights of A2976/0125419
The XLogP value of 2.7983 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2976/0125419. With a topological polar surface area (TPSA) of 53.09 Ų, A2976/0125419 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A2976/0125419 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 A2976/0125419?
The CAS number of A2976/0125419 is 522649-66-7.
What is the molecular formula of A2976/0125419?
The molecular formula of A2976/0125419 is C22H24ClN3O3.
What is the molecular weight of A2976/0125419?
The molecular weight of A2976/0125419 is 413.15 g/mol.
Where can I buy A2976/0125419?
You can request a quote for A2976/0125419 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2976/0125419?
Yes, KEHONG BIO provides custom synthesis services for A2976/0125419 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.