7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione
TL;DR: 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione (CAS 1005262-80-5) is a chemical compound with molecular formula C21H18N2O3 and molecular weight 346.13174 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-4,7-epoxyisoindole-1,3-dione
Also Known As: 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione, 2-phenyl-4-((phenylamino)methyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione, 2-phenyl-4-[(phenylamino)methyl]-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Technical Specifications
| Molecular Formula | C21H18N2O3 |
| Molecular Weight | 346.13174 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 346.13174 Da |
| Heavy Atoms | 26 |
| Complexity | 621.0 |
| SMILES | C1=CC=C(C=C1)NCC23C=CC(O2)C4C3C(=O)N(C4=O)C5=CC=CC=C5 |
| InChIKey | DVLWUFGRPQZUNT-UHFFFAOYSA-N |
Chemical Property Profile of 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione
Property Insights of 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione. With a topological polar surface area (TPSA) of 58.6 Ų, 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione 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 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione?
The CAS number of 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione is 1005262-80-5.
What is the molecular formula of 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione?
The molecular formula of 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione is C21H18N2O3.
What is the molecular weight of 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione?
The molecular weight of 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione is 346.13174 g/mol.
Where can I buy 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione?
You can request a quote for 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione?
Yes, CoreyChem provides custom synthesis services for 7-(anilinomethyl)-2-phenyl-4,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.