AD 2239
TL;DR: AD 2239 (CAS 90852-27-0) is a chemical compound with molecular formula C17H26ClNO2 and molecular weight 311.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxy-2,3-dimethylphenyl)-2-methyl-3-pyrrolidin-1-ylpropan-1-one;hydrochloride
Also Known As: 1-Propanone, 1-(4-methoxy-2,3-dimethylphenyl)-2-methyl-3-(1-pyrrolidinyl)-, hydrochloride, 1-(2,3-Dimethyl-4-methoxyphenyl)-2-methyl-3-(1-pyrrolidinyl)-1-propanone HCl, 1-(4-methoxy-2,3-dimethylphenyl)-2-methyl-3-pyrrolidin-1-ylpropan-1-one;hydrochloride, 1-(2,3-Dimethyl-4-methoxyphenyl)-2-methyl-3-(1-pyrrolidinyl)-1-propanone hydrochloride, 1-(4-methoxy-2,3-dimethylphenyl)-2-methyl-3-pyrrolidin-1-ylpropan-1-one hydrochloride
| Molecular Formula | C17H26ClNO2 |
|---|---|
| Molecular Weight | 311.17 g/mol |
| LogP | 3.64844 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 311.1652 |
| Heavy Atoms | 21 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 90852-27-0 |
|---|---|
| SMILES | CC1=C(C=CC(=C1C)OC)C(=O)C(C)CN2CCCC2.Cl |
| InChIKey | QZZRTYDGEHAUFP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
AD 2239 (CAS 90852-27-0), with molecular formula C17H26ClNO2 and molecular weight 311.17 g/mol. IUPAC: 1-(4-methoxy-2,3-dimethylphenyl)-2-methyl-3-pyrrolidin-1-ylpropan-1-one;hydrochloride.
Chemical Property Profile of AD 2239
Property Insights of AD 2239
The XLogP value of 3.64844 indicates that AD 2239 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, AD 2239 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AD 2239 has 1 hydrogen bond donor(s) and 3 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 AD 2239?
The CAS number of AD 2239 is 90852-27-0.
What is the molecular formula of AD 2239?
The molecular formula of AD 2239 is C17H26ClNO2.
What is the molecular weight of AD 2239?
The molecular weight of AD 2239 is 311.17 g/mol.
Where can I buy AD 2239?
You can request a quote for AD 2239 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AD 2239?
Yes, KEHONG BIO provides custom synthesis services for AD 2239 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.