2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione
TL;DR: 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione (CAS 356090-46-5) is a chemical compound with molecular formula C21H18ClNO3 and molecular weight 367.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione
Also Known As: 2-(3-chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione, 2-(3-chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione, 2-(3-chloro-4-phenoxyphenyl)-5-methyl-4,7,3a,7a-tetrahydroisoindole-1,3-dione
| Molecular Formula | C21H18ClNO3 |
|---|---|
| Molecular Weight | 367.10 g/mol |
| LogP | 4.978 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 367.09753 |
| Heavy Atoms | 26 |
| Complexity | 906.7271 |
Chemical Identifiers
| CAS Number | 356090-46-5 |
|---|---|
| SMILES | CC1=CCC2C(C1)C(=O)N(C2=O)C3=CC(=C(C=C3)OC4=CC=CC=C4)Cl |
Product Overview
2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione (CAS 356090-46-5), with molecular formula C21H18ClNO3 and molecular weight 367.10 g/mol. IUPAC: 2-(3-chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione.
Chemical Property Profile of 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione
Property Insights of 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione
The XLogP value of 4.978 indicates that 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-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
Frequently Asked Questions
What is the CAS number of 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione?
The CAS number of 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione is 356090-46-5.
What is the molecular formula of 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione?
The molecular formula of 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione is C21H18ClNO3.
What is the molecular weight of 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione?
The molecular weight of 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione is 367.10 g/mol.
Where can I buy 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione?
You can request a quote for 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Chloro-4-phenoxyphenyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.