N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester
TL;DR: N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester (CAS 956624-46-7) is a chemical compound with molecular formula C28H22ClN3O5 and molecular weight 515.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dioxoisoindol-2-yl)ethyl (2S)-2-[(2-chlorobenzoyl)amino]-3-(1H-indol-3-yl)propanoate
Also Known As: N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester, 2-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl N-(2-chlorobenzoyl)-L-tryptophanate, 2-(1,3-dioxoisoindol-2-yl)ethyl (2S)-2-[(2-chlorobenzoyl)amino]-3-(1H-indol-3-yl)propanoate
| Molecular Formula | C28H22ClN3O5 |
|---|---|
| Molecular Weight | 515.12 g/mol |
| LogP | 4.0018 |
| Topological Polar Surface Area | 108.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 515.1248 |
| Heavy Atoms | 37 |
| Complexity | 1494.0483 |
Chemical Identifiers
| CAS Number | 956624-46-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCOC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)C5=CC=CC=C5Cl |
Product Overview
N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester (CAS 956624-46-7), with molecular formula C28H22ClN3O5 and molecular weight 515.12 g/mol. IUPAC: 2-(1,3-dioxoisoindol-2-yl)ethyl (2S)-2-[(2-chlorobenzoyl)amino]-3-(1H-indol-3-yl)propanoate.
Chemical Property Profile of N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester
Property Insights of N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester
The XLogP value of 4.0018 indicates that N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.57 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester. Following Lipinski's Rule of Five, N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester?
The CAS number of N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester is 956624-46-7.
What is the molecular formula of N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester?
The molecular formula of N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester is C28H22ClN3O5.
What is the molecular weight of N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester?
The molecular weight of N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester is 515.12 g/mol.
Where can I buy N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester?
You can request a quote for N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Chlorobenzoyl)-L-tryptophan 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.