4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate
TL;DR: 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate (CAS 49562-74-5) is a chemical compound with molecular formula C18H14ClNO4 and molecular weight 343.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl) 4-(1,3-dioxoisoindol-2-yl)butanoate
Also Known As: 4-chlorophenyl 4-(1,3-dioxoisoindolin-2-yl)butanoate, (4-chlorophenyl) 4-(1,3-dioxoisoindol-2-yl)butanoate, 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate
| Molecular Formula | C18H14ClNO4 |
|---|---|
| Molecular Weight | 343.06 g/mol |
| LogP | 3.3218 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.06113 |
| Heavy Atoms | 24 |
| Complexity | 765.92096 |
Chemical Identifiers
| CAS Number | 49562-74-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)OC3=CC=C(C=C3)Cl |
Product Overview
4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate (CAS 49562-74-5), with molecular formula C18H14ClNO4 and molecular weight 343.06 g/mol. IUPAC: (4-chlorophenyl) 4-(1,3-dioxoisoindol-2-yl)butanoate.
Chemical Property Profile of 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate
Property Insights of 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate
The XLogP value of 3.3218 indicates that 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate. Following Lipinski's Rule of Five, 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate has 0 hydrogen bond donor(s) and 4 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 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate?
The CAS number of 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate is 49562-74-5.
What is the molecular formula of 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate?
The molecular formula of 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate is C18H14ClNO4.
What is the molecular weight of 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate?
The molecular weight of 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate is 343.06 g/mol.
Where can I buy 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate?
You can request a quote for 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate?
Yes, KEHONG BIO provides custom synthesis services for 4-chlorophenyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.