BAS 01057502
TL;DR: BAS 01057502 (CAS 304643-41-2) is a chemical compound with molecular formula C25H22ClN3O3 and molecular weight 447.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[4-(2-chlorobenzoyl)piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione
Also Known As: BAS 01057502, BIM-0034212.P001, 2-(2-(4-(2-chlorobenzoyl)piperazin-1-yl)ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione, AB00097852-01, F0305-0016
| Molecular Formula | C25H22ClN3O3 |
|---|---|
| Molecular Weight | 447.13 g/mol |
| LogP | 3.5472 |
| Topological Polar Surface Area | 60.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 447.13498 |
| Heavy Atoms | 32 |
| Complexity | 1183.3341 |
Chemical Identifiers
| CAS Number | 304643-41-2 |
|---|---|
| SMILES | C1CN(CCN1CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C5=CC=CC=C5Cl |
Product Overview
BAS 01057502 (CAS 304643-41-2), with molecular formula C25H22ClN3O3 and molecular weight 447.13 g/mol. IUPAC: 2-[2-[4-(2-chlorobenzoyl)piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of BAS 01057502
Property Insights of BAS 01057502
The XLogP value of 3.5472 indicates that BAS 01057502 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.93 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01057502. Following Lipinski's Rule of Five, BAS 01057502 has 0 hydrogen bond donor(s) and 4 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 01057502?
The CAS number of BAS 01057502 is 304643-41-2.
What is the molecular formula of BAS 01057502?
The molecular formula of BAS 01057502 is C25H22ClN3O3.
What is the molecular weight of BAS 01057502?
The molecular weight of BAS 01057502 is 447.13 g/mol.
Where can I buy BAS 01057502?
You can request a quote for BAS 01057502 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01057502?
Yes, KEHONG BIO provides custom synthesis services for BAS 01057502 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.