![1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride structure](/static/products/6650/66504-75-4.webp)
1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride
TL;DR: 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride (CAS 66504-75-4) is a chemical compound with molecular formula C12H16ClN and molecular weight 209.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)-3-azabicyclo[3.1.0]hexane;hydrochloride
Also Known As: BICIFADINE HYDROCHLORIDE, Bicifadine HCl, (-)-Bicifadine Hydrochloride, Bicifadine-d5 Hydrochloride, (+)-Bicifadine Hydrochloride
| Molecular Formula | C12H16ClN |
|---|---|
| Molecular Weight | 209.10 g/mol |
| LogP | 2.28 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.09712 |
| Heavy Atoms | 14 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 66504-75-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C23CC2CNC3.Cl |
| InChIKey | OTZOPAFTLUOBOM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride (CAS 66504-75-4), with molecular formula C12H16ClN and molecular weight 209.10 g/mol. IUPAC: 1-(4-methylphenyl)-3-azabicyclo[3.1.0]hexane;hydrochloride.
Chemical Property Profile of 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride
Property Insights of 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride
The XLogP value of 2.28 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride. With a topological polar surface area (TPSA) of 12.0 Ų, 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride has 2 hydrogen bond donor(s) and 1 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-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride?
The CAS number of 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride is 66504-75-4.
What is the molecular formula of 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride?
The molecular formula of 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride is C12H16ClN.
What is the molecular weight of 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride?
The molecular weight of 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride is 209.10 g/mol.
Where can I buy 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride?
You can request a quote for 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methylphenyl)-3-azabicyclo[3.1.0]hexane hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.