RefChem:1096224
TL;DR: RefChem:1096224 (CAS 1057-63-2) is a chemical compound with molecular formula C24H27NO5 and molecular weight 409.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyloxy)piperidine
Also Known As: 3-((10,11-Dihydro-5H-dibenzo(a,d)cyclohepten-5-yl)oxy)piperidine fumarate, Piperidine, 3-((10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-yl)oxy)-, fumarate (1:1), RefChem:1096224
| Molecular Formula | C24H27NO5 |
|---|---|
| Molecular Weight | 409.19 g/mol |
| LogP | 3.355 |
| Topological Polar Surface Area | 95.86 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 409.18893 |
| Heavy Atoms | 30 |
| Complexity | 838.47424 |
Chemical Identifiers
| CAS Number | 1057-63-2 |
|---|---|
| SMILES | C1CC(CNC1)OC2C3=CC=CC=C3CCC4=CC=CC=C24.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1096224 (CAS 1057-63-2), with molecular formula C24H27NO5 and molecular weight 409.19 g/mol. IUPAC: (E)-but-2-enedioic acid;3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyloxy)piperidine.
Chemical Property Profile of RefChem:1096224
Property Insights of RefChem:1096224
The XLogP value of 3.355 indicates that RefChem:1096224 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.86 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1096224. Following Lipinski's Rule of Five, RefChem:1096224 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 RefChem:1096224?
The CAS number of RefChem:1096224 is 1057-63-2.
What is the molecular formula of RefChem:1096224?
The molecular formula of RefChem:1096224 is C24H27NO5.
What is the molecular weight of RefChem:1096224?
The molecular weight of RefChem:1096224 is 409.19 g/mol.
Where can I buy RefChem:1096224?
You can request a quote for RefChem:1096224 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1096224?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1096224 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.