吡斯的明
TL;DR: 吡斯的明 (CAS 155-97-5) is a chemical compound with molecular formula C9H13N2O2+ and molecular weight 181.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
吡斯的明
(1-methylpyridin-1-ium-3-yl) N,N-dimethylcarbamate
Also Known As: pyridostigmine, Pyridostigminum, Mestinon, Regonol, Pyridostigmine ion
| Molecular Formula | C9H13N2O2+ |
|---|---|
| Molecular Weight | 181.10 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 33.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 181.0977 |
| Heavy Atoms | 13 |
| Complexity | 182.0 |
| Melting Point | 152-154 |
| Solubility | 100 |
Chemical Identifiers
| CAS Number | 155-97-5 |
|---|---|
| SMILES | C[N+]1=CC=CC(=C1)OC(=O)N(C)C |
| InChIKey | RVOLLAQWKVFTGE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
吡斯的明 (CAS 155-97-5), with molecular formula C9H13N2O2+ and molecular weight 181.10 g/mol. IUPAC: (1-methylpyridin-1-ium-3-yl) N,N-dimethylcarbamate.
Chemical Property Profile of 吡斯的明
Property Insights of 吡斯的明
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 吡斯的明. With a topological polar surface area (TPSA) of 33.4 Ų, 吡斯的明 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 吡斯的明 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 吡斯的明?
The CAS number of 吡斯的明 is 155-97-5.
What is the molecular formula of 吡斯的明?
The molecular formula of 吡斯的明 is C9H13N2O2+.
What is the molecular weight of 吡斯的明?
The molecular weight of 吡斯的明 is 181.10 g/mol.
Where can I buy 吡斯的明?
You can request a quote for 吡斯的明 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 吡斯的明?
Yes, KEHONG BIO provides custom synthesis services for 吡斯的明 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.