Trinitrophenylglutamyllysine
TL;DR: Trinitrophenylglutamyllysine (CAS 123774-73-2) is a chemical compound with molecular formula C17H22N6O11 and molecular weight 486.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-6-amino-2-(N-[(2S)-2-amino-4-carboxybutanoyl]anilino)-2,3,3-trinitrohexanoic acid
Also Known As: Tnp-dgl, Tnp-glu-lys, Trinitrophenylglutamyllysine, alpha-Glutamyl-2,3,3-trinitro-N~2~-phenyllysine, L-alpha-Glutamyl-2,3,3-trinitro-N~2~-phenyl-L-lysine
| Molecular Formula | C17H22N6O11 |
|---|---|
| Molecular Weight | 486.13 g/mol |
| LogP | -5.3 |
| Topological Polar Surface Area | 284.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 11 |
| Exact Mass | 486.13464 |
| Heavy Atoms | 34 |
| Complexity | 800.0 |
Chemical Identifiers
| CAS Number | 123774-73-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N(C(=O)[C@H](CCC(=O)O)N)[C@](C(=O)O)(C(CCCN)([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | NLIVJYRNWMZLSY-SJCJKPOMSA-N |
Product Overview
Trinitrophenylglutamyllysine (CAS 123774-73-2), with molecular formula C17H22N6O11 and molecular weight 486.13 g/mol. IUPAC: (2R)-6-amino-2-(N-[(2S)-2-amino-4-carboxybutanoyl]anilino)-2,3,3-trinitrohexanoic acid.
Chemical Property Profile of Trinitrophenylglutamyllysine
Property Insights of Trinitrophenylglutamyllysine
The XLogP value of -5.3 indicates that Trinitrophenylglutamyllysine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 284.0 Ų indicates high polarity, suggesting Trinitrophenylglutamyllysine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Trinitrophenylglutamyllysine has 4 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Trinitrophenylglutamyllysine?
The CAS number of Trinitrophenylglutamyllysine is 123774-73-2.
What is the molecular formula of Trinitrophenylglutamyllysine?
The molecular formula of Trinitrophenylglutamyllysine is C17H22N6O11.
What is the molecular weight of Trinitrophenylglutamyllysine?
The molecular weight of Trinitrophenylglutamyllysine is 486.13 g/mol.
Where can I buy Trinitrophenylglutamyllysine?
You can request a quote for Trinitrophenylglutamyllysine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trinitrophenylglutamyllysine?
Yes, KEHONG BIO provides custom synthesis services for Trinitrophenylglutamyllysine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.