RefChem:1053530
TL;DR: RefChem:1053530 (CAS 54809-43-7) is a chemical compound with molecular formula C16H24BrNO and molecular weight 325.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,9S,14R)-1,11,14-trimethyl-11-azatricyclo[7.4.1.02,7]tetradeca-2(7),3,5-trien-4-ol;hydrobromide
Also Known As: 1,4,12-beta-Trimethyl-10-hydroxy-2,3,4,5,6,7-hexahydro-1,6-methano-1H-4-benzazonine HBr, 1,6-Methano-1H-4-benzazonin-10-ol, 2,3,4,5,6,7-hexahydro-1,4,12-trimethyl-, hydrobromide, (1-alpha,6-alpha,12R*)-, (1R,6S,12R)-1,4,12-Trimethyl-2,3,4,5,6,7-hexahydro-1H-1,6-methano-4-benzazonin-10-ol--hydrogen bromide (1/1), 1,4,12-Trimethyl-2,3,4,5,6,7-hexahydro-1H-1,6-methano-4-benzazonin-10-ol--hydrogen bromide (1/1), RefChem:1053530
| Molecular Formula | C16H24BrNO |
|---|---|
| Molecular Weight | 325.10 g/mol |
| LogP | 3.3717 |
| Topological Polar Surface Area | 23.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 325.10413 |
| Heavy Atoms | 19 |
| Complexity | 475.81677 |
Chemical Identifiers
| CAS Number | 54809-43-7 |
|---|---|
| SMILES | C[C@@H]1[C@@H]2CC3=C([C@@]1(CCN(C2)C)C)C=C(C=C3)O.Br |
Product Overview
RefChem:1053530 (CAS 54809-43-7), with molecular formula C16H24BrNO and molecular weight 325.10 g/mol. IUPAC: (1R,9S,14R)-1,11,14-trimethyl-11-azatricyclo[7.4.1.02,7]tetradeca-2(7),3,5-trien-4-ol;hydrobromide.
Chemical Property Profile of RefChem:1053530
Property Insights of RefChem:1053530
The XLogP value of 3.3717 indicates that RefChem:1053530 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.47 Ų, RefChem:1053530 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1053530 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 RefChem:1053530?
The CAS number of RefChem:1053530 is 54809-43-7.
What is the molecular formula of RefChem:1053530?
The molecular formula of RefChem:1053530 is C16H24BrNO.
What is the molecular weight of RefChem:1053530?
The molecular weight of RefChem:1053530 is 325.10 g/mol.
Where can I buy RefChem:1053530?
You can request a quote for RefChem:1053530 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1053530?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1053530 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.