1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl-
TL;DR: 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl- (CAS 67707-85-1) is a chemical compound with molecular formula C13H30N4 and molecular weight 242.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,8-trimethyl-1,4,8,11-tetrazacyclotetradecane
Also Known As: Trimethylcyclam, 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl-, 1,4,8-trimethyl-1,4,8,11-tetraazacyclotetradecane, 1,4,8-trimethyl-1,4,8,11-tetrazacyclotetradecane, 1,4,11-Trimethyl-1,4,8,11-tetraazacyclotetradecane
| Molecular Formula | C13H30N4 |
|---|---|
| Molecular Weight | 242.25 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 21.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 242.24704 |
| Heavy Atoms | 17 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 67707-85-1 |
|---|---|
| SMILES | CN1CCCNCCN(CCCN(CC1)C)C |
| InChIKey | NWTDWQBLYRISDC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl- (CAS 67707-85-1), with molecular formula C13H30N4 and molecular weight 242.25 g/mol. IUPAC: 1,4,8-trimethyl-1,4,8,11-tetrazacyclotetradecane.
Chemical Property Profile of 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl-
Property Insights of 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl-
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl-. With a topological polar surface area (TPSA) of 21.8 Ų, 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl- has 1 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 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl-?
The CAS number of 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl- is 67707-85-1.
What is the molecular formula of 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl-?
The molecular formula of 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl- is C13H30N4.
What is the molecular weight of 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl-?
The molecular weight of 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl- is 242.25 g/mol.
Where can I buy 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl-?
You can request a quote for 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,4,8,11-Tetraazacyclotetradecane, 1,4,8-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.