RefChem:1095741
TL;DR: RefChem:1095741 (CAS 25558-84-3) is a chemical compound with molecular formula C24H28N2O6 and molecular weight 440.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;1-(3-methoxy-5,6-dihydrobenzo[b][1]benzoxepin-5-yl)-4-methylpiperazine
Also Known As: 1-(10,11-Dihydro-8-methoxydibenz(b,f)oxepin-10-yl)-4-methylpiperazine maleate, Piperazine, 1-(10,11-dihydro-8-methoxydibenz(b,f)oxepin-10-yl)-4-methyl-, maleate (1:1), (E)-but-2-enedioic acid; 1-(3-methoxy-5,6-dihydrobenzo[b][1]benzoxepin-5-yl)-4-methylpiperazine, RefChem:1095741
| Molecular Formula | C24H28N2O6 |
|---|---|
| Molecular Weight | 440.19 g/mol |
| LogP | 3.0439 |
| Topological Polar Surface Area | 99.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 440.19473 |
| Heavy Atoms | 32 |
| Complexity | 966.2048 |
Chemical Identifiers
| CAS Number | 25558-84-3 |
|---|---|
| SMILES | CN1CCN(CC1)C2CC3=CC=CC=C3OC4=C2C=C(C=C4)OC.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1095741 (CAS 25558-84-3), with molecular formula C24H28N2O6 and molecular weight 440.19 g/mol. IUPAC: (E)-but-2-enedioic acid;1-(3-methoxy-5,6-dihydrobenzo[b][1]benzoxepin-5-yl)-4-methylpiperazine.
Chemical Property Profile of RefChem:1095741
Property Insights of RefChem:1095741
The XLogP value of 3.0439 indicates that RefChem:1095741 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.54 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1095741. Following Lipinski's Rule of Five, RefChem:1095741 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 RefChem:1095741?
The CAS number of RefChem:1095741 is 25558-84-3.
What is the molecular formula of RefChem:1095741?
The molecular formula of RefChem:1095741 is C24H28N2O6.
What is the molecular weight of RefChem:1095741?
The molecular weight of RefChem:1095741 is 440.19 g/mol.
Where can I buy RefChem:1095741?
You can request a quote for RefChem:1095741 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1095741?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1095741 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.