Pithecolobine
TL;DR: Pithecolobine (CAS 22368-82-7) is a chemical compound with molecular formula C22H46N4O and molecular weight 382.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-nonyl-1,5,9,13-tetrazacycloheptadecan-6-one
Also Known As: Pithecolobine, 8-nonyl-1,5,9,13-tetrazacycloheptadecan-6-one, 8-NONYL-1,5,9,13-TETRAAZACYCLOHEPTADECAN-6-ONE, 1,5,10,14-Tetraazacyclononadecan-15-one, 19-heptyl-10-hydroxy-
| Molecular Formula | C22H46N4O |
|---|---|
| Molecular Weight | 382.37 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 65.2 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 382.36716 |
| Heavy Atoms | 27 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 22368-82-7 |
|---|---|
| SMILES | CCCCCCCCCC1CC(=O)NCCCNCCCCNCCCN1 |
| InChIKey | QEGMJRQKNQFEEZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pithecolobine (CAS 22368-82-7), with molecular formula C22H46N4O and molecular weight 382.37 g/mol. IUPAC: 8-nonyl-1,5,9,13-tetrazacycloheptadecan-6-one.
Chemical Property Profile of Pithecolobine
Property Insights of Pithecolobine
The XLogP value of 4.0 indicates that Pithecolobine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Pithecolobine. Following Lipinski's Rule of Five, Pithecolobine has 4 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 Pithecolobine?
The CAS number of Pithecolobine is 22368-82-7.
What is the molecular formula of Pithecolobine?
The molecular formula of Pithecolobine is C22H46N4O.
What is the molecular weight of Pithecolobine?
The molecular weight of Pithecolobine is 382.37 g/mol.
Where can I buy Pithecolobine?
You can request a quote for Pithecolobine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pithecolobine?
Yes, KEHONG BIO provides custom synthesis services for Pithecolobine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.