去甲可替宁
TL;DR: 去甲可替宁 (CAS 17708-87-1) is a chemical compound with molecular formula C9H10N2O and molecular weight 162.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
去甲可替宁
5-pyridin-3-ylpyrrolidin-2-one
Also Known As: norcotinine, (R,S)-Norcotinine, demethylcotinine, rac-Norcotinine, 5-(PYRIDIN-3-YL)PYRROLIDIN-2-ONE
| Molecular Formula | C9H10N2O |
|---|---|
| Molecular Weight | 162.08 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 162.07932 |
| Heavy Atoms | 12 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 17708-87-1 |
|---|---|
| SMILES | C1CC(=O)NC1C2=CN=CC=C2 |
| InChIKey | FXFANIORDKRCCA-UHFFFAOYSA-N |
Product Overview
去甲可替宁 (CAS 17708-87-1), with molecular formula C9H10N2O and molecular weight 162.08 g/mol. IUPAC: 5-pyridin-3-ylpyrrolidin-2-one.
Chemical Property Profile of 去甲可替宁
Property Insights of 去甲可替宁
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 去甲可替宁. With a topological polar surface area (TPSA) of 42.0 Ų, 去甲可替宁 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 去甲可替宁 has 1 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 去甲可替宁?
The CAS number of 去甲可替宁 is 17708-87-1.
What is the molecular formula of 去甲可替宁?
The molecular formula of 去甲可替宁 is C9H10N2O.
What is the molecular weight of 去甲可替宁?
The molecular weight of 去甲可替宁 is 162.08 g/mol.
Where can I buy 去甲可替宁?
You can request a quote for 去甲可替宁 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 去甲可替宁?
Yes, KEHONG BIO provides custom synthesis services for 去甲可替宁 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.