LU 3-043
TL;DR: LU 3-043 (CAS 10589-01-2) is a chemical compound with molecular formula C25H36Cl2N2O2 and molecular weight 466.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[3-(3,3-dimethyl-1-phenyl-2-benzofuran-1-yl)propyl]piperazin-1-yl]ethanol;dihydrochloride
Also Known As: LU 3-043, Phthalan, 3,3-dimethyl-1-(3-(4-(2-hydroxyethyl)piperazinyl)propyl)-1-phenyl-, dihydrochloride, 2-{4-[3-(3,3-dimethyl-1-phenyl-1,3-dihydro-2-benzofuran-1-yl)propyl]piperazin-1-yl}ethanol dihydrochloride, 2-[4-[3-(3,3-dimethyl-1-phenyl-2-benzofuran-1-yl)propyl]piperazin-1-yl]ethanol dihydrochloride, 2-{4-[3-(3,3-Dimethyl-1-phenyl-1,3-dihydro-2-benzofuran-1-yl)propyl]piperazin-1-yl}ethan-1-ol--hydrogen chloride (1/2)
| Molecular Formula | C25H36Cl2N2O2 |
|---|---|
| Molecular Weight | 466.22 g/mol |
| LogP | 4.43 |
| Topological Polar Surface Area | 35.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 466.2154 |
| Heavy Atoms | 31 |
| Complexity | 511.0 |
Chemical Identifiers
| CAS Number | 10589-01-2 |
|---|---|
| SMILES | CC1(C2=CC=CC=C2C(O1)(CCCN3CCN(CC3)CCO)C4=CC=CC=C4)C.Cl.Cl |
| InChIKey | QHPIKJYLKLSWLD-UHFFFAOYSA-N |
Product Overview
LU 3-043 (CAS 10589-01-2), with molecular formula C25H36Cl2N2O2 and molecular weight 466.22 g/mol. IUPAC: 2-[4-[3-(3,3-dimethyl-1-phenyl-2-benzofuran-1-yl)propyl]piperazin-1-yl]ethanol;dihydrochloride.
Chemical Property Profile of LU 3-043
Property Insights of LU 3-043
The XLogP value of 4.43 indicates that LU 3-043 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.9 Ų, LU 3-043 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, LU 3-043 has 3 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 LU 3-043?
The CAS number of LU 3-043 is 10589-01-2.
What is the molecular formula of LU 3-043?
The molecular formula of LU 3-043 is C25H36Cl2N2O2.
What is the molecular weight of LU 3-043?
The molecular weight of LU 3-043 is 466.22 g/mol.
Where can I buy LU 3-043?
You can request a quote for LU 3-043 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for LU 3-043?
Yes, KEHONG BIO provides custom synthesis services for LU 3-043 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.