Sophocarpine hydrobromide
TL;DR: Sophocarpine hydrobromide (CAS 78003-71-1) is a chemical compound with molecular formula C15H23BrN2O and molecular weight 326.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2R,9S,17S)-7,13-diazatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-6-one;hydrobromide
Also Known As: sophocarpine hydrobromide, Sophocarpine, Sophocarpine, hydrobromide, sophocarpinehydrobromide, 13,14-Didehydromatridin-15-one hydrobromide
| Molecular Formula | C15H23BrN2O |
|---|---|
| Molecular Weight | 326.10 g/mol |
| LogP | 2.2256 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 326.09937 |
| Heavy Atoms | 19 |
| Complexity | 395.6068 |
Chemical Identifiers
| CAS Number | 78003-71-1 |
|---|---|
| SMILES | C1C[C@H]2CN3[C@H](CC=CC3=O)[C@@H]4[C@H]2N(C1)CCC4.Br |
Product Overview
Sophocarpine hydrobromide (CAS 78003-71-1), with molecular formula C15H23BrN2O and molecular weight 326.10 g/mol. IUPAC: (1R,2R,9S,17S)-7,13-diazatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-6-one;hydrobromide.
Chemical Property Profile of Sophocarpine hydrobromide
Property Insights of Sophocarpine hydrobromide
The XLogP value of 2.2256 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sophocarpine hydrobromide. With a topological polar surface area (TPSA) of 23.55 Ų, Sophocarpine hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sophocarpine hydrobromide has 0 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 Sophocarpine hydrobromide?
The CAS number of Sophocarpine hydrobromide is 78003-71-1.
What is the molecular formula of Sophocarpine hydrobromide?
The molecular formula of Sophocarpine hydrobromide is C15H23BrN2O.
What is the molecular weight of Sophocarpine hydrobromide?
The molecular weight of Sophocarpine hydrobromide is 326.10 g/mol.
Where can I buy Sophocarpine hydrobromide?
You can request a quote for Sophocarpine hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sophocarpine hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for Sophocarpine hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.