2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
TL;DR: 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione (CAS 1005281-64-0) is a chemical compound with molecular formula C16H17NO3 and molecular weight 271.12085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(3-methoxyphenyl)-4-azatricyclo[5.2.1.02,6]decane-3,5-dione
Also Known As: 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Technical Specifications
| Molecular Formula | C16H17NO3 |
| Molecular Weight | 271.12085 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.12085 Da |
| Heavy Atoms | 20 |
| Complexity | 421.0 |
| SMILES | COC1=CC=CC(=C1)N2C(=O)C3C4CCC(C4)C3C2=O |
| InChIKey | DPEQYIJODAORDC-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Property Insights of 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione. With a topological polar surface area (TPSA) of 46.6 Ų, 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione 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
What is the CAS number of 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione?
The CAS number of 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione is 1005281-64-0.
What is the molecular formula of 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione?
The molecular formula of 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione is C16H17NO3.
What is the molecular weight of 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione?
The molecular weight of 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione is 271.12085 g/mol.
Where can I buy 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione?
You can request a quote for 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione?
Yes, CoreyChem provides custom synthesis services for 2-(3-methoxyphenyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.