methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate
TL;DR: methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate (CAS 355422-60-5) is a chemical compound with molecular formula C22H20Cl2N2O5 and molecular weight 462.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[2-(5,6-dichloro-1,3-dioxoisoindol-2-yl)hexanoylamino]benzoate
Also Known As: methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate, methyl 4-{[2-(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoyl]amino}benzoate, Methyl 4-[2-(5,6-dichloro-1,3-dioxo-isoindol-2-yl)hexanoylamino]benzoate, methyl 4-[2-(5,6-dichloro-1,3-dioxoisoindol-2-yl)hexanoylamino]benzoate, methyl 4-[2-(5,6-dichloro-1,3-dioxobenzo[c]azolin-2-yl)hexanoylamino]benzoate
| Molecular Formula | C22H20Cl2N2O5 |
|---|---|
| Molecular Weight | 462.07 g/mol |
| LogP | 4.5735 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 462.07492 |
| Heavy Atoms | 31 |
| Complexity | 1011.61194 |
Chemical Identifiers
| CAS Number | 355422-60-5 |
|---|---|
| SMILES | CCCCC(C(=O)NC1=CC=C(C=C1)C(=O)OC)N2C(=O)C3=CC(=C(C=C3C2=O)Cl)Cl |
Product Overview
methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate (CAS 355422-60-5), with molecular formula C22H20Cl2N2O5 and molecular weight 462.07 g/mol. IUPAC: methyl 4-[2-(5,6-dichloro-1,3-dioxoisoindol-2-yl)hexanoylamino]benzoate.
Chemical Property Profile of methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate
Property Insights of methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate
The XLogP value of 4.5735 indicates that methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate. Following Lipinski's Rule of Five, methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate has 1 hydrogen bond donor(s) and 5 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 methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate?
The CAS number of methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate is 355422-60-5.
What is the molecular formula of methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate?
The molecular formula of methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate is C22H20Cl2N2O5.
What is the molecular weight of methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate?
The molecular weight of methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate is 462.07 g/mol.
Where can I buy methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate?
You can request a quote for methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-(2-(5,6-dichloro-1,3-dioxoisoindolin-2-yl)hexanamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.