2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one
TL;DR: 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one (CAS 1008972-21-1) is a chemical compound with molecular formula C15H21ClN2O3 and molecular weight 312.12408 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(5-chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one
Also Known As: 2-(5-chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one, 2-(5-Chloro-2,4-dimethoxyanilino)-1-(pyrrolidin-1-yl)propan-1-one
Technical Specifications
| Molecular Formula | C15H21ClN2O3 |
| Molecular Weight | 312.12408 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.12408 Da |
| Heavy Atoms | 21 |
| Complexity | 350.0 |
| SMILES | CC(C(=O)N1CCCC1)NC2=CC(=C(C=C2OC)OC)Cl |
| InChIKey | QUKANIWDDDSLSA-UHFFFAOYSA-N |
Chemical Property Profile of 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one
Property Insights of 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one. With a topological polar surface area (TPSA) of 50.8 Ų, 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one?
The CAS number of 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one is 1008972-21-1.
What is the molecular formula of 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one?
The molecular formula of 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one is C15H21ClN2O3.
What is the molecular weight of 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one?
The molecular weight of 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one is 312.12408 g/mol.
Where can I buy 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one?
You can request a quote for 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one?
Yes, CoreyChem provides custom synthesis services for 2-(5-Chloro-2,4-dimethoxyanilino)-1-pyrrolidin-1-ylpropan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.