Metheptazine
TL;DR: Metheptazine (CAS 469-78-3) is a chemical compound with molecular formula C16H23NO2 and molecular weight 261.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1,2-dimethyl-4-phenylazepane-4-carboxylate
Also Known As: Metheptazine, Metheptazine [INN], Metoheptazina, methyl 1,2-dimethyl-4-phenylazepane-4-carboxylate, Methyl 1,2-dimethyl-4-phenyl-4-azepanylcarboxylat
| Molecular Formula | C16H23NO2 |
|---|---|
| Molecular Weight | 261.17 g/mol |
| LogP | 2.6016 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.17288 |
| Heavy Atoms | 19 |
| Complexity | 431.6349 |
Chemical Identifiers
| CAS Number | 469-78-3 |
|---|---|
| SMILES | CC1CC(CCCN1C)(C2=CC=CC=C2)C(=O)OC |
Product Overview
Metheptazine (CAS 469-78-3), with molecular formula C16H23NO2 and molecular weight 261.17 g/mol. IUPAC: methyl 1,2-dimethyl-4-phenylazepane-4-carboxylate.
Chemical Property Profile of Metheptazine
Property Insights of Metheptazine
The XLogP value of 2.6016 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Metheptazine. With a topological polar surface area (TPSA) of 29.54 Ų, Metheptazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Metheptazine has 0 hydrogen bond donor(s) and 3 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 Metheptazine?
The CAS number of Metheptazine is 469-78-3.
What is the molecular formula of Metheptazine?
The molecular formula of Metheptazine is C16H23NO2.
What is the molecular weight of Metheptazine?
The molecular weight of Metheptazine is 261.17 g/mol.
Where can I buy Metheptazine?
You can request a quote for Metheptazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Metheptazine?
Yes, KEHONG BIO provides custom synthesis services for Metheptazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.