![2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone structure](/static/products/4780/478040-83-4.webp)
2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone
TL;DR: 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone (CAS 478040-83-4) is a chemical compound with molecular formula C18H24N2O3 and molecular weight 316.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl)-3H-isoindol-1-one
Also Known As: Bionet2_001115, 2-[3-methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone, 2-(4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl)-3H-isoindol-1-one, 2-[4-methyl-1-(morpholin-4-yl)-1-oxopentan-2-yl]-2,3-dihydro-1H-isoindol-1-one
| Molecular Formula | C18H24N2O3 |
|---|---|
| Molecular Weight | 316.18 g/mol |
| LogP | 1.9159 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 316.17868 |
| Heavy Atoms | 23 |
| Complexity | 593.68445 |
Chemical Identifiers
| CAS Number | 478040-83-4 |
|---|---|
| SMILES | CC(C)CC(C(=O)N1CCOCC1)N2CC3=CC=CC=C3C2=O |
Product Overview
2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone (CAS 478040-83-4), with molecular formula C18H24N2O3 and molecular weight 316.18 g/mol. IUPAC: 2-(4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl)-3H-isoindol-1-one.
Chemical Property Profile of 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone
Property Insights of 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone
The XLogP value of 1.9159 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone. With a topological polar surface area (TPSA) of 49.85 Ų, 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone has 0 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 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone?
The CAS number of 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone is 478040-83-4.
What is the molecular formula of 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone?
The molecular formula of 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone is C18H24N2O3.
What is the molecular weight of 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone?
The molecular weight of 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone is 316.18 g/mol.
Where can I buy 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone?
You can request a quote for 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-Methyl-1-(morpholinocarbonyl)butyl]-1-isoindolinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.