Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan
TL;DR: Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan (CAS 141594-26-5) is a chemical compound with molecular formula C35H44N6O5 and molecular weight 628.33734 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-[[2-[[(2S)-2-(azepane-1-carbonylamino)-4-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
Also Known As: Perhydroazepin-1-yl-leu-trp-trp, BQ 485, Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan, D-Tryptophan, N-(N-(N-((hexahydro-1H-azepin-1-yl)carbonyl)-L-leucyl)-D-tryptophyl)-, N-(N-(N-((Hexahydro-1H-azepin-1-yl)carbonyl)-L-leucyl)-D-tryptophyl)-D-tryptophan
Technical Specifications
| Molecular Formula | C35H44N6O5 |
| Molecular Weight | 628.33734 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 159.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 628.33734 Da |
| Heavy Atoms | 46 |
| Complexity | 1050.0 |
| SMILES | CC(C)C[C@@H](C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)N[C@H](CC3=CNC4=CC=CC=C43)C(=O)O)NC(=O)N5CCCCCC5 |
| InChIKey | ZBJNAHVLKNFOPP-GAGJGVLVSA-N |
Chemical Property Profile of Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan
Property Insights of Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan
The XLogP value of 4.5 indicates that Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 159.0 Ų indicates high polarity, suggesting Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan has 6 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan?
The CAS number of Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan is 141594-26-5.
What is the molecular formula of Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan?
The molecular formula of Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan is C35H44N6O5.
What is the molecular weight of Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan?
The molecular weight of Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan is 628.33734 g/mol.
Where can I buy Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan?
You can request a quote for Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan?
Yes, CoreyChem provides custom synthesis services for Perhydroazepin-1-yl leucyl-tryptophyl-tryptophan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.