N-Phthaloylalanine methyl ester
TL;DR: N-Phthaloylalanine methyl ester (CAS 33745-25-4) is a chemical compound with molecular formula C12H11NO4 and molecular weight 233.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(1,3-dioxoisoindol-2-yl)propanoate
Also Known As: Methyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate, N-PHTHALOYLALANINE METHYL ESTER, methyl 2-(1,3-dioxoisoindol-2-yl)propanoate, 2-Phthalimidylpropanoic acid methyl ester, (S)-Methyl 2-(1,3-dioxoisoindolin-2-yl)propanoate
| Molecular Formula | C12H11NO4 |
|---|---|
| Molecular Weight | 233.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 63.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.0688 |
| Heavy Atoms | 17 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 33745-25-4 |
|---|---|
| SMILES | CC(C(=O)OC)N1C(=O)C2=CC=CC=C2C1=O |
| InChIKey | NNHVWQRYVXVZLH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Phthaloylalanine methyl ester (CAS 33745-25-4), with molecular formula C12H11NO4 and molecular weight 233.07 g/mol. IUPAC: methyl 2-(1,3-dioxoisoindol-2-yl)propanoate.
Chemical Property Profile of N-Phthaloylalanine methyl ester
Property Insights of N-Phthaloylalanine methyl ester
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Phthaloylalanine methyl ester. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Phthaloylalanine methyl ester. Following Lipinski's Rule of Five, N-Phthaloylalanine methyl ester 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 N-Phthaloylalanine methyl ester?
The CAS number of N-Phthaloylalanine methyl ester is 33745-25-4.
What is the molecular formula of N-Phthaloylalanine methyl ester?
The molecular formula of N-Phthaloylalanine methyl ester is C12H11NO4.
What is the molecular weight of N-Phthaloylalanine methyl ester?
The molecular weight of N-Phthaloylalanine methyl ester is 233.07 g/mol.
Where can I buy N-Phthaloylalanine methyl ester?
You can request a quote for N-Phthaloylalanine methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Phthaloylalanine methyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-Phthaloylalanine methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.