Pyroglutamylasparaginyltryptophan
TL;DR: Pyroglutamylasparaginyltryptophan (CAS 7724-45-0) is a chemical compound with molecular formula C20H23N5O6 and molecular weight 429.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(2S)-4-amino-4-oxo-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]butanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
Also Known As: 1kug, pyroglutamylasparaginyltryptophan, 5-Oxo-L-prolyl-L-asparaginyl-L-tryptophan, L-Tryptophan, 5-oxo-L-prolyl-L-asparaginyl-, (2S)-2-[[(2S)-4-amino-4-oxo-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]butanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
| Molecular Formula | C20H23N5O6 |
|---|---|
| Molecular Weight | 429.16 g/mol |
| LogP | -1.7 |
| Topological Polar Surface Area | 183.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 429.16483 |
| Heavy Atoms | 31 |
| Complexity | 744.0 |
Chemical Identifiers
| CAS Number | 7724-45-0 |
|---|---|
| SMILES | C1CC(=O)N[C@@H]1C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)O |
| InChIKey | PEKCKCSKJLOOLM-KKUMJFAQSA-N |
Product Overview
Pyroglutamylasparaginyltryptophan (CAS 7724-45-0), with molecular formula C20H23N5O6 and molecular weight 429.16 g/mol. IUPAC: (2S)-2-[[(2S)-4-amino-4-oxo-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]butanoyl]amino]-3-(1H-indol-3-yl)propanoic acid.
Chemical Property Profile of Pyroglutamylasparaginyltryptophan
Property Insights of Pyroglutamylasparaginyltryptophan
The XLogP value of -1.7 indicates that Pyroglutamylasparaginyltryptophan is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 183.0 Ų indicates high polarity, suggesting Pyroglutamylasparaginyltryptophan may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pyroglutamylasparaginyltryptophan has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyroglutamylasparaginyltryptophan?
The CAS number of Pyroglutamylasparaginyltryptophan is 7724-45-0.
What is the molecular formula of Pyroglutamylasparaginyltryptophan?
The molecular formula of Pyroglutamylasparaginyltryptophan is C20H23N5O6.
What is the molecular weight of Pyroglutamylasparaginyltryptophan?
The molecular weight of Pyroglutamylasparaginyltryptophan is 429.16 g/mol.
Where can I buy Pyroglutamylasparaginyltryptophan?
You can request a quote for Pyroglutamylasparaginyltryptophan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyroglutamylasparaginyltryptophan?
Yes, KEHONG BIO provides custom synthesis services for Pyroglutamylasparaginyltryptophan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.