RefChem:1090546
TL;DR: RefChem:1090546 (CAS 10565-86-3) is a chemical compound with molecular formula C20H28Cl2N2 and molecular weight 366.16296 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl-[3-(2-methyl-1-phenyl-2,3-dihydroisoindol-2-ium-1-yl)propyl]azanium dichloride
Also Known As: LU 3-045, ISOINDOLINE, 1-(3-DIMETHYLAMINOPROPYL)-2-METHYL-1-PHENYL-, DIHYDROCHLORIDE, dimethyl-[3-(2-methyl-1-phenyl-2,3-dihydroisoindol-2-ium-1-yl)propyl]azanium dichloride, Propylamine, N,N-dimethyl-3-(2-methyl-1-phenylisoindolin-1-yl)-, dihydrochloride, dimethyl-[3-(2-methyl-1-phenyl-3H-isoindol-1-yl)propyl]azanium,dichloride
Technical Specifications
| Molecular Formula | C20H28Cl2N2 |
| Molecular Weight | 366.16296 g/mol |
| XLogP | -5.11 |
| Topological Polar Surface Area (TPSA) | 8.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.16296 Da |
| Heavy Atoms | 24 |
| Complexity | 348.0 |
| SMILES | C[NH+]1CC2=CC=CC=C2C1(CCC[NH+](C)C)C3=CC=CC=C3.[Cl-].[Cl-] |
| InChIKey | NKGDBNZWJKTIEF-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:1090546
Property Insights of RefChem:1090546
The XLogP value of -5.11 indicates that RefChem:1090546 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 8.9 Ų, RefChem:1090546 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1090546 has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1090546?
The CAS number of RefChem:1090546 is 10565-86-3.
What is the molecular formula of RefChem:1090546?
The molecular formula of RefChem:1090546 is C20H28Cl2N2.
What is the molecular weight of RefChem:1090546?
The molecular weight of RefChem:1090546 is 366.16296 g/mol.
Where can I buy RefChem:1090546?
You can request a quote for RefChem:1090546 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1090546?
Yes, CoreyChem provides custom synthesis services for RefChem:1090546 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.