5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one
TL;DR: 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one (CAS 484049-68-5) is a chemical compound with molecular formula C23H27NO and molecular weight 333.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[anilino(phenyl)methyl]-5,5,6-trimethylbicyclo[2.2.1]heptan-2-one
Also Known As: 5,5,6-trimethyl-3-[phenyl(phenylamino)methyl]bicyclo[2.2.1]heptan-2-one, 3-[Anilino(phenyl)methyl]-5,5,6-trimethylbicyclo[2.2.1]heptan-2-one, A2549/0108534, 3-[Anilino(phenyl)methyl]-5,5,6-trimethylbicyclo[2.2.1]heptan-2-one #, 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one
| Molecular Formula | C23H27NO |
|---|---|
| Molecular Weight | 333.21 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.20926 |
| Heavy Atoms | 25 |
| Complexity | 486.0 |
Chemical Identifiers
| CAS Number | 484049-68-5 |
|---|---|
| SMILES | CC1C2CC(C1(C)C)C(C2=O)C(C3=CC=CC=C3)NC4=CC=CC=C4 |
| InChIKey | AFKLAVFLSMAXRE-UHFFFAOYSA-N |
Product Overview
5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one (CAS 484049-68-5), with molecular formula C23H27NO and molecular weight 333.21 g/mol. IUPAC: 3-[anilino(phenyl)methyl]-5,5,6-trimethylbicyclo[2.2.1]heptan-2-one.
Chemical Property Profile of 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one
Property Insights of 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one
The XLogP value of 5.3 indicates that 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one?
The CAS number of 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one is 484049-68-5.
What is the molecular formula of 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one?
The molecular formula of 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one is C23H27NO.
What is the molecular weight of 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one?
The molecular weight of 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one is 333.21 g/mol.
Where can I buy 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one?
You can request a quote for 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5,5,6-Trimethyl-3-(phenyl(phenylamino)methyl)bicyclo(2.2.1)heptan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.