RefChem:1071425
TL;DR: RefChem:1071425 (CAS 36576-73-5) is a chemical compound with molecular formula C27H35NO7 and molecular weight 485.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;ethyl 1-(9-oxo-2-bicyclo[3.3.1]nonanyl)-4-phenylpiperidine-4-carboxylate
Also Known As: 1-(9-Oxobicyclo(3.3.1)non-2-yl)-4-phenyl-4-piperidinecarboxylic acid ethyl ester maleate, 4-Piperidinecarboxylic acid, 1-(9-oxobicyclo(3.3.1)non-2-yl)-4-phenyl-, ethyl ester, maleate, (E)-but-2-enedioic acid; ethyl 1-(9-oxo-4-bicyclo[3.3.1]nonanyl)-4-phenylpiperidine-4-carboxylate, RefChem:1071425
| Molecular Formula | C27H35NO7 |
|---|---|
| Molecular Weight | 485.24 g/mol |
| LogP | 3.4429 |
| Topological Polar Surface Area | 121.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 485.24136 |
| Heavy Atoms | 35 |
| Complexity | 918.108 |
Chemical Identifiers
| CAS Number | 36576-73-5 |
|---|---|
| SMILES | CCOC(=O)C1(CCN(CC1)C2CCC3CCCC2C3=O)C4=CC=CC=C4.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1071425 (CAS 36576-73-5), with molecular formula C27H35NO7 and molecular weight 485.24 g/mol. IUPAC: (E)-but-2-enedioic acid;ethyl 1-(9-oxo-2-bicyclo[3.3.1]nonanyl)-4-phenylpiperidine-4-carboxylate.
Chemical Property Profile of RefChem:1071425
Property Insights of RefChem:1071425
The XLogP value of 3.4429 indicates that RefChem:1071425 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.21 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1071425. Following Lipinski's Rule of Five, RefChem:1071425 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:1071425?
The CAS number of RefChem:1071425 is 36576-73-5.
What is the molecular formula of RefChem:1071425?
The molecular formula of RefChem:1071425 is C27H35NO7.
What is the molecular weight of RefChem:1071425?
The molecular weight of RefChem:1071425 is 485.24 g/mol.
Where can I buy RefChem:1071425?
You can request a quote for RefChem:1071425 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1071425?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1071425 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.