Dezocine monohydrobromide
TL;DR: Dezocine monohydrobromide (CAS 57236-36-9) 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,15S)-15-amino-1-methyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol;hydrobromide
Also Known As: Dezocine monohydrobromide, Dezocine hydrobromide, Dezocine HBr, DEZOCINE, MCV 4206
| Molecular Formula | C16H24BrNO |
|---|---|
| Molecular Weight | 325.10 g/mol |
| LogP | 3.6915 |
| Topological Polar Surface Area | 46.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 325.10413 |
| Heavy Atoms | 19 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 57236-36-9 |
|---|---|
| SMILES | C[C@]12CCCCC[C@H]([C@@H]1N)CC3=C2C=C(C=C3)O.Br |
| InChIKey | HLYQVVMHTCPUKR-RXAPEJBRSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dezocine monohydrobromide (CAS 57236-36-9), with molecular formula C16H24BrNO and molecular weight 325.10 g/mol. IUPAC: (1R,9S,15S)-15-amino-1-methyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol;hydrobromide.
Chemical Property Profile of Dezocine monohydrobromide
Property Insights of Dezocine monohydrobromide
The XLogP value of 3.6915 indicates that Dezocine monohydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.3 Ų, Dezocine monohydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dezocine monohydrobromide has 3 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 Dezocine monohydrobromide?
The CAS number of Dezocine monohydrobromide is 57236-36-9.
What is the molecular formula of Dezocine monohydrobromide?
The molecular formula of Dezocine monohydrobromide is C16H24BrNO.
What is the molecular weight of Dezocine monohydrobromide?
The molecular weight of Dezocine monohydrobromide is 325.10 g/mol.
Where can I buy Dezocine monohydrobromide?
You can request a quote for Dezocine monohydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dezocine monohydrobromide?
Yes, KEHONG BIO provides custom synthesis services for Dezocine monohydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.