BIM-0045180.P001
TL;DR: BIM-0045180.P001 (CAS 113549-78-3) is a chemical compound with molecular formula C22H28Cl2N2O4 and molecular weight 454.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chlorophenoxy)-3-[4-[3-(2-chlorophenoxy)-2-hydroxypropyl]piperazin-1-yl]propan-2-ol
Also Known As: BIM-0045180.P001, 1,1'-piperazine-1,4-diylbis[3-(2-chlorophenoxy)propan-2-ol], 1-(2-chlorophenoxy)-3-[4-[3-(2-chlorophenoxy)-2-hydroxypropyl]piperazin-1-yl]propan-2-ol, 3,3'-(piperazine-1,4-diyl)bis(1-(2-chlorophenoxy)propan-2-ol)
| Molecular Formula | C22H28Cl2N2O4 |
|---|---|
| Molecular Weight | 454.14 g/mol |
| LogP | 2.7906 |
| Topological Polar Surface Area | 65.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 454.1426 |
| Heavy Atoms | 30 |
| Complexity | 721.7378 |
Chemical Identifiers
| CAS Number | 113549-78-3 |
|---|---|
| SMILES | C1CN(CCN1CC(COC2=CC=CC=C2Cl)O)CC(COC3=CC=CC=C3Cl)O |
Product Overview
BIM-0045180.P001 (CAS 113549-78-3), with molecular formula C22H28Cl2N2O4 and molecular weight 454.14 g/mol. IUPAC: 1-(2-chlorophenoxy)-3-[4-[3-(2-chlorophenoxy)-2-hydroxypropyl]piperazin-1-yl]propan-2-ol.
Chemical Property Profile of BIM-0045180.P001
Property Insights of BIM-0045180.P001
The XLogP value of 2.7906 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0045180.P001. The TPSA of 65.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0045180.P001. Following Lipinski's Rule of Five, BIM-0045180.P001 has 2 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 BIM-0045180.P001?
The CAS number of BIM-0045180.P001 is 113549-78-3.
What is the molecular formula of BIM-0045180.P001?
The molecular formula of BIM-0045180.P001 is C22H28Cl2N2O4.
What is the molecular weight of BIM-0045180.P001?
The molecular weight of BIM-0045180.P001 is 454.14 g/mol.
Where can I buy BIM-0045180.P001?
You can request a quote for BIM-0045180.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0045180.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0045180.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.