BIM-0049587.P001
TL;DR: BIM-0049587.P001 (CAS 6117-11-9) is a chemical compound with molecular formula C20H22Cl2N2O2 and molecular weight 392.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-2-methylphenoxy)-1-[4-(3-chlorophenyl)piperazin-1-yl]propan-1-one
Also Known As: BIM-0049587.P001, 2-(4-chloro-2-methylphenoxy)-1-[4-(3-chlorophenyl)piperazin-1-yl]propan-1-one, 1-[2-(4-chloro-2-methylphenoxy)propanoyl]-4-(3-chlorophenyl)piperazine, 2-(4-CHLORO-2-METHYLPHENOXY)-1-[4-(3-CHLOROPHENYL)PIPERAZINO]-1-PROPANONE
| Molecular Formula | C20H22Cl2N2O2 |
|---|---|
| Molecular Weight | 392.11 g/mol |
| LogP | 4.41792 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 392.10583 |
| Heavy Atoms | 26 |
| Complexity | 789.1307 |
Chemical Identifiers
| CAS Number | 6117-11-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)OC(C)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl |
Product Overview
BIM-0049587.P001 (CAS 6117-11-9), with molecular formula C20H22Cl2N2O2 and molecular weight 392.11 g/mol. IUPAC: 2-(4-chloro-2-methylphenoxy)-1-[4-(3-chlorophenyl)piperazin-1-yl]propan-1-one.
Chemical Property Profile of BIM-0049587.P001
Property Insights of BIM-0049587.P001
The XLogP value of 4.41792 indicates that BIM-0049587.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.78 Ų, BIM-0049587.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0049587.P001 has 0 hydrogen bond donor(s) and 3 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-0049587.P001?
The CAS number of BIM-0049587.P001 is 6117-11-9.
What is the molecular formula of BIM-0049587.P001?
The molecular formula of BIM-0049587.P001 is C20H22Cl2N2O2.
What is the molecular weight of BIM-0049587.P001?
The molecular weight of BIM-0049587.P001 is 392.11 g/mol.
Where can I buy BIM-0049587.P001?
You can request a quote for BIM-0049587.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0049587.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0049587.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.