3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride
TL;DR: 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride (CAS 70421-97-5) is a chemical compound with molecular formula C16H19ClN2O and molecular weight 290.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-indol-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-one;hydrochloride
Also Known As: 2-(3-Indolylmethyl)-3-quinuclidinone hydrochloride, 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride, 2-(1H-indol-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-one hydrochloride, 2-[(1H-Indol-3-yl)methyl]-1-azabicyclo[2.2.2]octan-3-one--hydrogen chloride (1/1), RefChem:282613
| Molecular Formula | C16H19ClN2O |
|---|---|
| Molecular Weight | 290.12 g/mol |
| LogP | 2.7955 |
| Topological Polar Surface Area | 36.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 290.1186 |
| Heavy Atoms | 20 |
| Complexity | 628.1935 |
Chemical Identifiers
| CAS Number | 70421-97-5 |
|---|---|
| SMILES | C1CN2CCC1C(=O)C2CC3=CNC4=CC=CC=C43.Cl |
Product Overview
3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride (CAS 70421-97-5), with molecular formula C16H19ClN2O and molecular weight 290.12 g/mol. IUPAC: 2-(1H-indol-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-one;hydrochloride.
Chemical Property Profile of 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride
Property Insights of 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride
The XLogP value of 2.7955 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride. With a topological polar surface area (TPSA) of 36.1 Ų, 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride 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 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride?
The CAS number of 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride is 70421-97-5.
What is the molecular formula of 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride?
The molecular formula of 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride is C16H19ClN2O.
What is the molecular weight of 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride?
The molecular weight of 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride is 290.12 g/mol.
Where can I buy 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride?
You can request a quote for 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Quinuclidinone, 2-(3-indolylmethyl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.