BIM-0038489.P001
TL;DR: BIM-0038489.P001 (CAS 302575-47-9) is a chemical compound with molecular formula C21H20Cl2N2O3 and molecular weight 418.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,4-dichlorophenyl)-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]chromen-4-one
Also Known As: BIM-0038489.P001, AE-641/13212085, 3-(2,4-dichlorophenyl)-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one, 3-(2,4-dichlorophenyl)-7-hydroxy-8-((4-methylpiperazin-1-yl)methyl)-4H-chromen-4-one, 3-(2,4-dichlorophenyl)-7-hydroxy-8-[(4-methyl-1-piperazinyl)methyl]-4H-chromen-4-one
| Molecular Formula | C21H20Cl2N2O3 |
|---|---|
| Molecular Weight | 418.09 g/mol |
| LogP | 4.2198 |
| Topological Polar Surface Area | 56.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 418.08508 |
| Heavy Atoms | 28 |
| Complexity | 1088.9363 |
Chemical Identifiers
| CAS Number | 302575-47-9 |
|---|---|
| SMILES | CN1CCN(CC1)CC2=C(C=CC3=C2OC=C(C3=O)C4=C(C=C(C=C4)Cl)Cl)O |
Product Overview
BIM-0038489.P001 (CAS 302575-47-9), with molecular formula C21H20Cl2N2O3 and molecular weight 418.09 g/mol. IUPAC: 3-(2,4-dichlorophenyl)-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]chromen-4-one.
Chemical Property Profile of BIM-0038489.P001
Property Insights of BIM-0038489.P001
The XLogP value of 4.2198 indicates that BIM-0038489.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.92 Ų, BIM-0038489.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0038489.P001 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 BIM-0038489.P001?
The CAS number of BIM-0038489.P001 is 302575-47-9.
What is the molecular formula of BIM-0038489.P001?
The molecular formula of BIM-0038489.P001 is C21H20Cl2N2O3.
What is the molecular weight of BIM-0038489.P001?
The molecular weight of BIM-0038489.P001 is 418.09 g/mol.
Where can I buy BIM-0038489.P001?
You can request a quote for BIM-0038489.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0038489.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0038489.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.