4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol
TL;DR: 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol (CAS 126824-06-4) is a chemical compound with molecular formula C25H22N4O3 and molecular weight 426.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[6-[6-(4-methylpiperazin-1-yl)-1,3-benzoxazol-2-yl]-1,3-benzoxazol-2-yl]phenol
Also Known As: 1-chloro-2-isopentylsulfanyl-ethane, 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol, 4-[6-(4-Methylpiperazin-1-yl)-2,6 -bi(benzoxazol)-2 -yl]phenol, 4-[6-[6-(4-methylpiperazin-1-yl)-1,3-benzoxazol-2-yl]-3H-1,3-benzoxazol-2-ylidene]cyclohexa-2,5-dien-1-one, 4-{6-[6-(4-methylpiperazin-1-yl)-1,3-benzoxazol-2-yl]-1,3-benzoxazol-2-yl}phenol
| Molecular Formula | C25H22N4O3 |
|---|---|
| Molecular Weight | 426.17 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 78.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 426.1692 |
| Heavy Atoms | 32 |
| Complexity | 637.0 |
Chemical Identifiers
| CAS Number | 126824-06-4 |
|---|---|
| SMILES | CN1CCN(CC1)C2=CC3=C(C=C2)N=C(O3)C4=CC5=C(C=C4)N=C(O5)C6=CC=C(C=C6)O |
| InChIKey | DTFGZBQANJETMF-UHFFFAOYSA-N |
Product Overview
4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol (CAS 126824-06-4), with molecular formula C25H22N4O3 and molecular weight 426.17 g/mol. IUPAC: 4-[6-[6-(4-methylpiperazin-1-yl)-1,3-benzoxazol-2-yl]-1,3-benzoxazol-2-yl]phenol.
Chemical Property Profile of 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol
Property Insights of 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol
The XLogP value of 4.5 indicates that 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol. Following Lipinski's Rule of Five, 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol has 1 hydrogen bond donor(s) and 7 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 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol?
The CAS number of 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol is 126824-06-4.
What is the molecular formula of 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol?
The molecular formula of 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol is C25H22N4O3.
What is the molecular weight of 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol?
The molecular weight of 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol is 426.17 g/mol.
Where can I buy 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol?
You can request a quote for 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-(6-(4-Methyl-1-piperazinyl)(2,6'-bibenzoxazol)-2'-yl)-phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.