RefChem:1060329
TL;DR: RefChem:1060329 (CAS 49822-16-4) is a chemical compound with molecular formula C15H22ClN and molecular weight 251.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,9S,13R)-1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene;hydrochloride
Also Known As: alpha-5,9-Dimethyl-2(N)-methyl-6,7-benzomorphan hydrochloride, 2,6-Methano-3-benzazocine, 1,2,3,4,5,6-hexahydro-3,6,11-alpha-trimethyl-, hydrochloride, (2S,6R,11R)-3,6,11-Trimethyl-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocine--hydrogen chloride (1/1), 2,6-Methano-3-benzazocine, 1,2,3,4,5,6-hexahydro-3,6,11-trimethyl-, hydrochloride, (2.alpha.,6.alpha.,11R*)-, 3,6,11-Trimethyl-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocine--hydrogen chloride (1/1)
| Molecular Formula | C15H22ClN |
|---|---|
| Molecular Weight | 251.14 g/mol |
| LogP | 3.2624 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 251.14407 |
| Heavy Atoms | 17 |
| Complexity | 417.1378 |
Chemical Identifiers
| CAS Number | 49822-16-4 |
|---|---|
| SMILES | C[C@H]1[C@@H]2CC3=CC=CC=C3[C@@]1(CCN2C)C.Cl |
Product Overview
RefChem:1060329 (CAS 49822-16-4), with molecular formula C15H22ClN and molecular weight 251.14 g/mol. IUPAC: (1R,9S,13R)-1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene;hydrochloride.
Chemical Property Profile of RefChem:1060329
Property Insights of RefChem:1060329
The XLogP value of 3.2624 indicates that RefChem:1060329 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, RefChem:1060329 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1060329 has 0 hydrogen bond donor(s) and 1 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:1060329?
The CAS number of RefChem:1060329 is 49822-16-4.
What is the molecular formula of RefChem:1060329?
The molecular formula of RefChem:1060329 is C15H22ClN.
What is the molecular weight of RefChem:1060329?
The molecular weight of RefChem:1060329 is 251.14 g/mol.
Where can I buy RefChem:1060329?
You can request a quote for RefChem:1060329 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1060329?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1060329 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.