Aplysamine 1
TL;DR: Aplysamine 1 (CAS 159026-30-9) is a chemical compound with molecular formula C15H24Br2N2O and molecular weight 406.02554 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2,6-dibromo-4-[2-(dimethylamino)ethyl]phenoxy]-N,N-dimethylpropan-1-amine
Also Known As: Aplysamine 1, J1.813.936G, 3-[2,6-dibromo-4-[2-(dimethylamino)ethyl]phenoxy]-N,N-dimethylpropan-1-amine, 3-(2,6-Dibromo-4-(2-(dimethylamino)ethyl)phenoxy)-N,N-dimethyl-1-propanamine, 3-(2,6-dibromo-4-(2-(dimethylamino)ethyl)phenoxy)-N,N-dimethylpropan-1-amine
Technical Specifications
| Molecular Formula | C15H24Br2N2O |
| Molecular Weight | 406.02554 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 15.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 406.02554 Da |
| Heavy Atoms | 20 |
| Complexity | 252.0 |
| SMILES | CN(C)CCCOC1=C(C=C(C=C1Br)CCN(C)C)Br |
| InChIKey | LWENJEAGCYZOBC-UHFFFAOYSA-N |
Chemical Property Profile of Aplysamine 1
Property Insights of Aplysamine 1
The XLogP value of 4.0 indicates that Aplysamine 1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.7 Ų, Aplysamine 1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aplysamine 1 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
What is the CAS number of Aplysamine 1?
The CAS number of Aplysamine 1 is 159026-30-9.
What is the molecular formula of Aplysamine 1?
The molecular formula of Aplysamine 1 is C15H24Br2N2O.
What is the molecular weight of Aplysamine 1?
The molecular weight of Aplysamine 1 is 406.02554 g/mol.
Where can I buy Aplysamine 1?
You can request a quote for Aplysamine 1 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Aplysamine 1?
Yes, CoreyChem provides custom synthesis services for Aplysamine 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.