N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide
TL;DR: N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide (CAS 1023857-69-3) is a chemical compound with molecular formula C18H22N2O4 and molecular weight 330.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide
Also Known As: N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide, N-(1,3-dioxooctahydro-2H-isoindol-2-yl)-2-(4-methylphenoxy)propanamide, N-(1,3-dioxo(4,5,6,7,3a,7a-hexahydroisoindol-2-yl))-2-(4-methylphenoxy)propana mide
| Molecular Formula | C18H22N2O4 |
|---|---|
| Molecular Weight | 330.16 g/mol |
| LogP | 1.96872 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.15796 |
| Heavy Atoms | 24 |
| Complexity | 631.48755 |
Chemical Identifiers
| CAS Number | 1023857-69-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OC(C)C(=O)NN2C(=O)C3CCCCC3C2=O |
Product Overview
N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide (CAS 1023857-69-3), with molecular formula C18H22N2O4 and molecular weight 330.16 g/mol. IUPAC: N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide.
Chemical Property Profile of N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide
Property Insights of N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide
The XLogP value of 1.96872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide. Following Lipinski's Rule of Five, N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide 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
Frequently Asked Questions
What is the CAS number of N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide?
The CAS number of N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide is 1023857-69-3.
What is the molecular formula of N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide?
The molecular formula of N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide is C18H22N2O4.
What is the molecular weight of N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide?
The molecular weight of N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide is 330.16 g/mol.
Where can I buy N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide?
You can request a quote for N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-2-(4-methylphenoxy)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.