RefChem:1095743
TL;DR: RefChem:1095743 (CAS 25562-34-9) is a chemical compound with molecular formula C25H30N2O5 and molecular weight 438.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;1-ethyl-4-(3-methyl-5,6-dihydrobenzo[b][1]benzoxepin-5-yl)piperazine
Also Known As: 8-Methyl-10-(4-ethylpiperazino)-10,11-dihydrodibenz(b,f)oxepin maleate, Piperazine, 1-(10,11-dihydro-8-methyldibenz(b,f)oxepin-10-yl)-4-ethyl-, maleate (1:1), 1-(10,11-Dihydro-8-methyldibenz(b,f)oxepin-10-yl)-4-ethylpiperazine maleate, (E)-but-2-enedioic acid; 1-ethyl-4-(3-methyl-5,6-dihydrobenzo[b][1]benzoxepin-5-yl)piperazine, RefChem:1095743
| Molecular Formula | C25H30N2O5 |
|---|---|
| Molecular Weight | 438.22 g/mol |
| LogP | 3.73382 |
| Topological Polar Surface Area | 90.31 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.21548 |
| Heavy Atoms | 32 |
| Complexity | 964.0476 |
Chemical Identifiers
| CAS Number | 25562-34-9 |
|---|---|
| SMILES | CCN1CCN(CC1)C2CC3=CC=CC=C3OC4=C2C=C(C=C4)C.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1095743 (CAS 25562-34-9), with molecular formula C25H30N2O5 and molecular weight 438.22 g/mol. IUPAC: (E)-but-2-enedioic acid;1-ethyl-4-(3-methyl-5,6-dihydrobenzo[b][1]benzoxepin-5-yl)piperazine.
Chemical Property Profile of RefChem:1095743
Property Insights of RefChem:1095743
The XLogP value of 3.73382 indicates that RefChem:1095743 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.31 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1095743. Following Lipinski's Rule of Five, RefChem:1095743 has 2 hydrogen bond donor(s) and 5 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:1095743?
The CAS number of RefChem:1095743 is 25562-34-9.
What is the molecular formula of RefChem:1095743?
The molecular formula of RefChem:1095743 is C25H30N2O5.
What is the molecular weight of RefChem:1095743?
The molecular weight of RefChem:1095743 is 438.22 g/mol.
Where can I buy RefChem:1095743?
You can request a quote for RefChem:1095743 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1095743?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1095743 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.