1-Methylhomopiperazine
TL;DR: 1-Methylhomopiperazine (CAS 4318-37-0) is a chemical compound with molecular formula C6H14N2 and molecular weight 114.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-1,4-diazepane
Also Known As: N-Methylhomopiperazine, 1-Methyl-1,4-diazepane, 1-Methylhomopiperazine, N-methyl homopiperazine, methylhomopiperazine
| Molecular Formula | C6H14N2 |
|---|---|
| Molecular Weight | 114.12 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 15.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 114.1157 |
| Heavy Atoms | 8 |
| Complexity | 63.0 |
Chemical Identifiers
| CAS Number | 4318-37-0 |
|---|---|
| SMILES | CN1CCCNCC1 |
| InChIKey | FXHRAKUEZPSMLJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methylhomopiperazine (CAS 4318-37-0), with molecular formula C6H14N2 and molecular weight 114.12 g/mol. IUPAC: 1-methyl-1,4-diazepane.
Chemical Property Profile of 1-Methylhomopiperazine
Property Insights of 1-Methylhomopiperazine
The XLogP value of -0.4 indicates that 1-Methylhomopiperazine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 15.3 Ų, 1-Methylhomopiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylhomopiperazine has 1 hydrogen bond donor(s) and 2 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-Methylhomopiperazine?
The CAS number of 1-Methylhomopiperazine is 4318-37-0.
What is the molecular formula of 1-Methylhomopiperazine?
The molecular formula of 1-Methylhomopiperazine is C6H14N2.
What is the molecular weight of 1-Methylhomopiperazine?
The molecular weight of 1-Methylhomopiperazine is 114.12 g/mol.
Where can I buy 1-Methylhomopiperazine?
You can request a quote for 1-Methylhomopiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methylhomopiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methylhomopiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.