N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester
TL;DR: N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester (CAS 1037422-45-9) is a chemical compound with molecular formula C24H18ClN3O5 and molecular weight 463.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) (2S)-2-[(2-chlorobenzoyl)amino]-3-(1H-indol-3-yl)propanoate
Also Known As: N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester, 4-Nitrophenyl N-(2-chlorobenzoyl)-L-tryptophanate, (4-nitrophenyl) (2S)-2-[(2-chlorobenzoyl)amino]-3-(1H-indol-3-yl)propanoate
| Molecular Formula | C24H18ClN3O5 |
|---|---|
| Molecular Weight | 463.09 g/mol |
| LogP | 4.6762 |
| Topological Polar Surface Area | 114.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 463.0935 |
| Heavy Atoms | 33 |
| Complexity | 1333.4545 |
Chemical Identifiers
| CAS Number | 1037422-45-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)OC3=CC=C(C=C3)[N+](=O)[O-])NC(=O)C4=CC=CC=C4Cl |
Product Overview
N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester (CAS 1037422-45-9), with molecular formula C24H18ClN3O5 and molecular weight 463.09 g/mol. IUPAC: (4-nitrophenyl) (2S)-2-[(2-chlorobenzoyl)amino]-3-(1H-indol-3-yl)propanoate.
Chemical Property Profile of N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester
Property Insights of N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester
The XLogP value of 4.6762 indicates that N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.33 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester. Following Lipinski's Rule of Five, N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester has 2 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 N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester?
The CAS number of N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester is 1037422-45-9.
What is the molecular formula of N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester?
The molecular formula of N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester is C24H18ClN3O5.
What is the molecular weight of N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester?
The molecular weight of N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester is 463.09 g/mol.
Where can I buy N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester?
You can request a quote for N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl 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 4-nitrophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Chlorobenzoyl)-L-tryptophan 4-nitrophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.