Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide
TL;DR: Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide (CAS 106984-12-7) is a chemical compound with molecular formula C32H49N7O8 and molecular weight 659.36426 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-[(2S)-5-amino-1-[[(2S)-6-amino-1-[[(2S)-6-amino-2-[(4-methyl-2-oxochromen-7-yl)amino]hexanoyl]amino]-1-oxohexan-2-yl]amino]-1,5-dioxopentan-2-yl]carbamate
Also Known As: Boc-glu-lys-lys-NH-mec, Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide, tert-butyl N-[(2S)-5-amino-1-[[(2S)-6-amino-1-[[(2S)-6-amino-2-[(4-methyl-2-oxochromen-7-yl)amino]hexanoyl]amino]-1-oxohexan-2-yl]amino]-1,5-dioxopentan-2-yl]carbamate, L-Lysinamide, N2-((1,1-dimethylethoxy)carbonyl)-L-glutaminyl-L-lysyl-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-, N~2~-(tert-Butoxycarbonyl)-L-glutaminyl-N-{(2S)-6-amino-2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)amino]hexanoyl}-L-lysinamide
Technical Specifications
| Molecular Formula | C32H49N7O8 |
| Molecular Weight | 659.36426 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 247.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 20 |
| Exact Mass | 659.36426 Da |
| Heavy Atoms | 47 |
| Complexity | 1140.0 |
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)N[C@@H](CCCCN)C(=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N)NC(=O)OC(C)(C)C |
| InChIKey | IKULHSRMJQPVTD-HJOGWXRNSA-N |
Chemical Property Profile of Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide
Property Insights of Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide. The TPSA of 247.0 Ų indicates high polarity, suggesting Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide has 7 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide?
The CAS number of Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide is 106984-12-7.
What is the molecular formula of Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide?
The molecular formula of Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide is C32H49N7O8.
What is the molecular weight of Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide?
The molecular weight of Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide is 659.36426 g/mol.
Where can I buy Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide?
You can request a quote for Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide?
Yes, CoreyChem provides custom synthesis services for Butoxycarbonylglutamyl-lysyl-lysine-4-methylcoumarinyl-7-amide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.