(±)-可替宁
TL;DR: (±)-可替宁 (CAS 15569-85-4) is a chemical compound with molecular formula C10H12N2O and molecular weight 176.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(±)-可替宁
1-methyl-5-pyridin-3-ylpyrrolidin-2-one
Also Known As: cotinine, (-)-Cotinine, rac Cotinine, rac-Cotinine, Cotinina
| Molecular Formula | C10H12N2O |
|---|---|
| Molecular Weight | 176.09 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 33.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.09496 |
| Heavy Atoms | 13 |
| Complexity | 205.0 |
| Melting Point | 41 °C |
Chemical Identifiers
| CAS Number | 15569-85-4 |
|---|---|
| SMILES | CN1C(CCC1=O)C2=CN=CC=C2 |
| InChIKey | UIKROCXWUNQSPJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(±)-可替宁 (CAS 15569-85-4), with molecular formula C10H12N2O and molecular weight 176.09 g/mol. IUPAC: 1-methyl-5-pyridin-3-ylpyrrolidin-2-one.
Chemical Property Profile of (±)-可替宁
Property Insights of (±)-可替宁
The XLogP value of -0.3 indicates that (±)-可替宁 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 33.2 Ų, (±)-可替宁 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (±)-可替宁 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 (±)-可替宁?
The CAS number of (±)-可替宁 is 15569-85-4.
What is the molecular formula of (±)-可替宁?
The molecular formula of (±)-可替宁 is C10H12N2O.
What is the molecular weight of (±)-可替宁?
The molecular weight of (±)-可替宁 is 176.09 g/mol.
Where can I buy (±)-可替宁?
You can request a quote for (±)-可替宁 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (±)-可替宁?
Yes, KEHONG BIO provides custom synthesis services for (±)-可替宁 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.