![methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate structure](/static/products/7176/71765-95-2.webp)
methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate
TL;DR: methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate (CAS 71765-95-2) is a chemical compound with molecular formula C19H16ClNO4 and molecular weight 357.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)propanoate
Also Known As: methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate, methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)propanoate, methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)
| Molecular Formula | C19H16ClNO4 |
|---|---|
| Molecular Weight | 357.08 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 63.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 357.07678 |
| Heavy Atoms | 25 |
| Complexity | 506.0 |
Chemical Identifiers
| CAS Number | 71765-95-2 |
|---|---|
| SMILES | COC(=O)C(CC1=CC=C(C=C1)CCl)N2C(=O)C3=CC=CC=C3C2=O |
| InChIKey | JCRMLQKRCVOVAB-UHFFFAOYSA-N |
Product Overview
methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate (CAS 71765-95-2), with molecular formula C19H16ClNO4 and molecular weight 357.08 g/mol. IUPAC: methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxoisoindol-2-yl)propanoate.
Chemical Property Profile of methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate
Property Insights of methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate
The XLogP value of 3.2 indicates that methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate. Following Lipinski's Rule of Five, methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate 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 methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate?
The CAS number of methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate is 71765-95-2.
What is the molecular formula of methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate?
The molecular formula of methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate is C19H16ClNO4.
What is the molecular weight of methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate?
The molecular weight of methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate is 357.08 g/mol.
Where can I buy methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate?
You can request a quote for methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-[4-(chloromethyl)phenyl]-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.