![rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide structure](/static/products/121/1217649-96-1.webp)
rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide
TL;DR: rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide (CAS 1217649-96-1) is a chemical compound with molecular formula C20H24N2O4 and molecular weight 356.1736 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(3aS,7aR)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]propanamide
Also Known As: rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide, 3-[(3aR,7aS)-1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]propanamide, 3-[(3aR,7aS)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]propanamide
Technical Specifications
| Molecular Formula | C20H24N2O4 |
| Molecular Weight | 356.1736 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 75.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 356.1736 Da |
| Heavy Atoms | 26 |
| Complexity | 540.0 |
| SMILES | COC1=CC=C(C=C1)CCNC(=O)CCN2C(=O)[C@@H]3CC=CC[C@@H]3C2=O |
| InChIKey | KQUFFRQPEKDAOA-CALCHBBNSA-N |
Chemical Property Profile of rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide
Property Insights of rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide. The TPSA of 75.7 Ų falls within the moderate polarity range, balancing permeability and solubility for rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide. Following Lipinski's Rule of Five, rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-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
What is the CAS number of rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide?
The CAS number of rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide is 1217649-96-1.
What is the molecular formula of rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide?
The molecular formula of rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide is C20H24N2O4.
What is the molecular weight of rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide?
The molecular weight of rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide is 356.1736 g/mol.
Where can I buy rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide?
You can request a quote for rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide?
Yes, CoreyChem provides custom synthesis services for rel-(3aR,7aS)-1,3,3a,4,7,7a-Hexahydro-N-[2-(4-methoxyphenyl)ethyl]-1,3-dioxo-2H-isoindole-2-propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.