Physostigmine hydrobromide
TL;DR: Physostigmine hydrobromide (CAS 6091-13-0) is a chemical compound with molecular formula C15H22BrN3O2 and molecular weight 355.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-methylcarbamate;hydrobromide
Also Known As: Physostigmine hydrobromide, Physostigmine, monohydrobromide, (3aS,8aR)-1,3a,8-Trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl hydrogen methylcarbonimidate--hydrogen bromide (1/1), [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-methylcarbamate hydrobromide, 1,3a,8-Trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl hydrogen methylcarbonimidate--hydrogen bromide (1/1)
| Molecular Formula | C15H22BrN3O2 |
|---|---|
| Molecular Weight | 355.09 g/mol |
| LogP | 2.35 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 355.08954 |
| Heavy Atoms | 21 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 6091-13-0 |
|---|---|
| SMILES | C[C@@]12CCN([C@@H]1N(C3=C2C=C(C=C3)OC(=O)NC)C)C.Br |
| InChIKey | HFIWKRLOGGSAQX-PBCQUBLHSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Physostigmine hydrobromide (CAS 6091-13-0), with molecular formula C15H22BrN3O2 and molecular weight 355.09 g/mol. IUPAC: [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-methylcarbamate;hydrobromide.
Chemical Property Profile of Physostigmine hydrobromide
Property Insights of Physostigmine hydrobromide
The XLogP value of 2.35 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Physostigmine hydrobromide. With a topological polar surface area (TPSA) of 44.8 Ų, Physostigmine hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Physostigmine hydrobromide has 2 hydrogen bond donor(s) and 4 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 Physostigmine hydrobromide?
The CAS number of Physostigmine hydrobromide is 6091-13-0.
What is the molecular formula of Physostigmine hydrobromide?
The molecular formula of Physostigmine hydrobromide is C15H22BrN3O2.
What is the molecular weight of Physostigmine hydrobromide?
The molecular weight of Physostigmine hydrobromide is 355.09 g/mol.
Where can I buy Physostigmine hydrobromide?
You can request a quote for Physostigmine hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Physostigmine hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for Physostigmine hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.