A1856/0078117
TL;DR: A1856/0078117 (CAS 313378-59-5) is a chemical compound with molecular formula C24H28ClN3O4 and molecular weight 457.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(3-chlorophenyl)piperazin-1-yl]-1-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidine-2,5-dione
Also Known As: A1856/0078117, 3-[4-(3-chlorophenyl)piperazin-1-yl]-1-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidine-2,5-dione, 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(3-chlorophenyl)piperazinyl]azolidine-2, 5-dione, 3-(4-(3-chlorophenyl)piperazin-1-yl)-1-(3,4-dimethoxyphenethyl)pyrrolidine-2,5-dione
| Molecular Formula | C24H28ClN3O4 |
|---|---|
| Molecular Weight | 457.18 g/mol |
| LogP | 2.8494 |
| Topological Polar Surface Area | 62.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 457.17682 |
| Heavy Atoms | 32 |
| Complexity | 990.95966 |
Chemical Identifiers
| CAS Number | 313378-59-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C(=O)CC(C2=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)OC |
Product Overview
A1856/0078117 (CAS 313378-59-5), with molecular formula C24H28ClN3O4 and molecular weight 457.18 g/mol. IUPAC: 3-[4-(3-chlorophenyl)piperazin-1-yl]-1-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidine-2,5-dione.
Chemical Property Profile of A1856/0078117
Property Insights of A1856/0078117
The XLogP value of 2.8494 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A1856/0078117. The TPSA of 62.32 Ų falls within the moderate polarity range, balancing permeability and solubility for A1856/0078117. Following Lipinski's Rule of Five, A1856/0078117 has 0 hydrogen bond donor(s) and 6 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 A1856/0078117?
The CAS number of A1856/0078117 is 313378-59-5.
What is the molecular formula of A1856/0078117?
The molecular formula of A1856/0078117 is C24H28ClN3O4.
What is the molecular weight of A1856/0078117?
The molecular weight of A1856/0078117 is 457.18 g/mol.
Where can I buy A1856/0078117?
You can request a quote for A1856/0078117 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1856/0078117?
Yes, KEHONG BIO provides custom synthesis services for A1856/0078117 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.