5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione
TL;DR: 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione (CAS 474376-85-7) is a chemical compound with molecular formula C16H19NO2 and molecular weight 257.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2-(4-methylphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
Also Known As: 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione, 5-methyl-2-(4-methylphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione, 5-methyl-2-(4-methylphenyl)-4,5,6,7,3a,7a-hexahydroisoindole-1,3-dione, 5-METHYL-2-(4-METHYLPHENYL)-OCTAHYDRO-1H-ISOINDOLE-1,3-DIONE
| Molecular Formula | C16H19NO2 |
|---|---|
| Molecular Weight | 257.14 g/mol |
| LogP | 2.92062 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 257.14157 |
| Heavy Atoms | 19 |
| Complexity | 520.0554 |
Chemical Identifiers
| CAS Number | 474376-85-7 |
|---|---|
| SMILES | CC1CCC2C(C1)C(=O)N(C2=O)C3=CC=C(C=C3)C |
Product Overview
5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione (CAS 474376-85-7), with molecular formula C16H19NO2 and molecular weight 257.14 g/mol. IUPAC: 5-methyl-2-(4-methylphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione.
Chemical Property Profile of 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione
Property Insights of 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione
The XLogP value of 2.92062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione. With a topological polar surface area (TPSA) of 37.38 Ų, 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione has 0 hydrogen bond donor(s) and 2 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 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione?
The CAS number of 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione is 474376-85-7.
What is the molecular formula of 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione?
The molecular formula of 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione is C16H19NO2.
What is the molecular weight of 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione?
The molecular weight of 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione is 257.14 g/mol.
Where can I buy 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione?
You can request a quote for 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-methyl-2-(4-methylphenyl)hexahydro-1H-isoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.