BAS 00702847
TL;DR: BAS 00702847 (CAS 311775-16-3) is a chemical compound with molecular formula C23H28N4O4 and molecular weight 424.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidine-2,5-dione
Also Known As: BAS 00702847, A1408/0062947, 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidine-2,5-dione, 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(2-pyridinyl)-1-piperazinyl]-2,5-pyrrolidinedione, 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(pyridin-2-yl)piperazin-1-yl]pyrrolidine-2,5-dione
| Molecular Formula | C23H28N4O4 |
|---|---|
| Molecular Weight | 424.21 g/mol |
| LogP | 1.591 |
| Topological Polar Surface Area | 75.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.21106 |
| Heavy Atoms | 31 |
| Complexity | 928.42865 |
Chemical Identifiers
| CAS Number | 311775-16-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C(=O)CC(C2=O)N3CCN(CC3)C4=CC=CC=N4)OC |
Product Overview
BAS 00702847 (CAS 311775-16-3), with molecular formula C23H28N4O4 and molecular weight 424.21 g/mol. IUPAC: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidine-2,5-dione.
Chemical Property Profile of BAS 00702847
Property Insights of BAS 00702847
The XLogP value of 1.591 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00702847. The TPSA of 75.21 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00702847. Following Lipinski's Rule of Five, BAS 00702847 has 0 hydrogen bond donor(s) and 7 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 BAS 00702847?
The CAS number of BAS 00702847 is 311775-16-3.
What is the molecular formula of BAS 00702847?
The molecular formula of BAS 00702847 is C23H28N4O4.
What is the molecular weight of BAS 00702847?
The molecular weight of BAS 00702847 is 424.21 g/mol.
Where can I buy BAS 00702847?
You can request a quote for BAS 00702847 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00702847?
Yes, KEHONG BIO provides custom synthesis services for BAS 00702847 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.