RefChem:1060300
TL;DR: RefChem:1060300 (CAS 3857-73-6) is a chemical compound with molecular formula C17H26BrNO and molecular weight 339.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10,13-dimethyl-1-propyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol;hydrobromide
Also Known As: alpha-2'-Hydroxy-9-methyl-5-propyl-6,7-benzomorphan hydrobromide, 2,6-Methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-3,11-alpha-dimethyl-6-propyl-, hydrobromide, 2,6-Methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-3,11-dimethyl-6-propyl-, hydrobromide, stereoisomer, 3,11-Dimethyl-6-propyl-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocin-8-ol--hydrogen bromide (1/1), RefChem:1060300
| Molecular Formula | C17H26BrNO |
|---|---|
| Molecular Weight | 339.12 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 339.11978 |
| Heavy Atoms | 20 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 3857-73-6 |
|---|---|
| SMILES | CCCC12CCN(C(C1C)CC3=C2C=C(C=C3)O)C.Br |
| InChIKey | WXXARLNTUWARIW-UHFFFAOYSA-N |
Product Overview
RefChem:1060300 (CAS 3857-73-6), with molecular formula C17H26BrNO and molecular weight 339.12 g/mol. IUPAC: 10,13-dimethyl-1-propyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol;hydrobromide.
Chemical Property Profile of RefChem:1060300
Property Insights of RefChem:1060300
The XLogP value of 3.9 indicates that RefChem:1060300 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:1060300 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1060300 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:1060300?
The CAS number of RefChem:1060300 is 3857-73-6.
What is the molecular formula of RefChem:1060300?
The molecular formula of RefChem:1060300 is C17H26BrNO.
What is the molecular weight of RefChem:1060300?
The molecular weight of RefChem:1060300 is 339.12 g/mol.
Where can I buy RefChem:1060300?
You can request a quote for RefChem:1060300 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1060300?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1060300 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.