RefChem:1066149
TL;DR: RefChem:1066149 (CAS 28331-20-6) is a chemical compound with molecular formula C15H22BrNO and molecular weight 311.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R)-1,10-dimethyl-10-azatricyclo[7.4.1.02,7]tetradeca-2(7),3,5-trien-4-ol;hydrobromide
Also Known As: 2'-Hydroxy-2,6-dimethyl-7,8-homobenzomorphan hydrobromide, 2,3,4,5,6,7-Hexahydro-3,7-alpha-dimethyl-2,7-methano-1H-3-benzazonin-9-ol hydrobromide, 2,7-Methano-1H-3-benzazonin-9-ol, 2,3,4,5,6,7-hexahydro-3,7-alpha-dimethyl-, hydrobromide, 3,7-Dimethyl-2,3,4,5,6,7-hexahydro-1H-2,7-methano-3-benzazonin-9-ol--hydrogen bromide (1/1), (7R)-3,7-Dimethyl-2,3,4,5,6,7-hexahydro-1H-2,7-methano-3-benzazonin-9-ol--hydrogen bromide (1/1)
| Molecular Formula | C15H22BrNO |
|---|---|
| Molecular Weight | 311.09 g/mol |
| LogP | 3.2682 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 311.08847 |
| Heavy Atoms | 18 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 28331-20-6 |
|---|---|
| SMILES | C[C@@]12CCCN(C(C1)CC3=C2C=C(C=C3)O)C.Br |
| InChIKey | YZZXGMSNYIPQJE-LTXLLRJYSA-N |
Product Overview
RefChem:1066149 (CAS 28331-20-6), with molecular formula C15H22BrNO and molecular weight 311.09 g/mol. IUPAC: (1R)-1,10-dimethyl-10-azatricyclo[7.4.1.02,7]tetradeca-2(7),3,5-trien-4-ol;hydrobromide.
Chemical Property Profile of RefChem:1066149
Property Insights of RefChem:1066149
The XLogP value of 3.2682 indicates that RefChem:1066149 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, RefChem:1066149 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1066149 has 2 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:1066149?
The CAS number of RefChem:1066149 is 28331-20-6.
What is the molecular formula of RefChem:1066149?
The molecular formula of RefChem:1066149 is C15H22BrNO.
What is the molecular weight of RefChem:1066149?
The molecular weight of RefChem:1066149 is 311.09 g/mol.
Where can I buy RefChem:1066149?
You can request a quote for RefChem:1066149 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1066149?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1066149 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.