Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)-
TL;DR: Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)- (CAS 86706-07-2) is a chemical compound with molecular formula C21H30N2O and molecular weight 326.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-N-(4,8,8-trimethyl-1-azatricyclo[3.3.1.13,7]decan-4-yl)propanamide
Also Known As: N-(3-Phenylpropionyl)-4-amino-4,8,8-trimethyl-1-azaadamantane, Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)-, N-(4,8,8-Trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)benzenepropanamide, 3-Phenyl-N-(4,8,8-trimethyl-1-azatricyclo[3.3.1.1~3,7~]decan-4-yl)propanimidic acid, RefChem:325098
| Molecular Formula | C21H30N2O |
|---|---|
| Molecular Weight | 326.24 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.2358 |
| Heavy Atoms | 24 |
| Complexity | 478.0 |
Chemical Identifiers
| CAS Number | 86706-07-2 |
|---|---|
| SMILES | CC1(C2CC3CN1CC(C2)C3(C)NC(=O)CCC4=CC=CC=C4)C |
| InChIKey | NTNRUSZQDRVOCG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)- (CAS 86706-07-2), with molecular formula C21H30N2O and molecular weight 326.24 g/mol. IUPAC: 3-phenyl-N-(4,8,8-trimethyl-1-azatricyclo[3.3.1.13,7]decan-4-yl)propanamide.
Chemical Property Profile of Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)-
Property Insights of Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)-
The XLogP value of 3.1 indicates that Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)- 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 Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)-?
The CAS number of Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)- is 86706-07-2.
What is the molecular formula of Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)-?
The molecular formula of Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)- is C21H30N2O.
What is the molecular weight of Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)-?
The molecular weight of Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)- is 326.24 g/mol.
Where can I buy Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)-?
You can request a quote for Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenepropanamide, N-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.