2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione
TL;DR: 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione (CAS 126435-01-6) is a chemical compound with molecular formula C14H16BrNO4 and molecular weight 341.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromo-3,3-dimethoxybutyl)isoindole-1,3-dione
Also Known As: 2-(4-bromo-3,3-dimethoxybutyl)isoindole-1,3-dione, 12W-0222, F3395-2805, 2-(4-bromo-3,3-dimethoxybutyl)-2,3-dihydro-1H-isoindole-1,3-dione, 2-(4-bromo-3,3-dimethoxybutyl)-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C14H16BrNO4 |
|---|---|
| Molecular Weight | 341.03 g/mol |
| LogP | 2.0567 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 341.02628 |
| Heavy Atoms | 20 |
| Complexity | 484.39545 |
Chemical Identifiers
| CAS Number | 126435-01-6 |
|---|---|
| SMILES | COC(CCN1C(=O)C2=CC=CC=C2C1=O)(CBr)OC |
Product Overview
2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione (CAS 126435-01-6), with molecular formula C14H16BrNO4 and molecular weight 341.03 g/mol. IUPAC: 2-(4-bromo-3,3-dimethoxybutyl)isoindole-1,3-dione.
Chemical Property Profile of 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione
Property Insights of 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione
The XLogP value of 2.0567 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione. With a topological polar surface area (TPSA) of 55.84 Ų, 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione has 0 hydrogen bond donor(s) and 4 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 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione?
The CAS number of 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione is 126435-01-6.
What is the molecular formula of 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione?
The molecular formula of 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione is C14H16BrNO4.
What is the molecular weight of 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione?
The molecular weight of 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione is 341.03 g/mol.
Where can I buy 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione?
You can request a quote for 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Bromo-3,3-dimethoxybutyl)isoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.