Dansylglutamyl-glycyl-arginyl chloromethyl ester
TL;DR: Dansylglutamyl-glycyl-arginyl chloromethyl ester (CAS 119206-61-0) is a chemical compound with molecular formula C26H36ClN7O8S and molecular weight 641.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S)-5-[[2-[[(1S)-1-carboxy-4-(diaminomethylideneamino)butyl]amino]-2-oxoethyl]amino]-3-(chloromethyl)-4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-5-oxopentanoic acid
Also Known As: Degrck, Dansyl-glu-gly-arg-chloromethyl ester, Dansylglutamyl-glycyl-arginyl chloromethyl ester, (4S)-5-[[2-[[(1S)-1-carboxy-4-(diaminomethylideneamino)butyl]amino]-2-oxoethyl]amino]-3-(chloromethyl)-4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-5-oxopentanoic acid, L-Arginine, N2-(N-(N-((5-(dimethylamino)-1-naphthalenyl)sulfonyl)-L-alpha-glutamyl)glycyl)-, 1-(chloromethyl) ester
| Molecular Formula | C26H36ClN7O8S |
|---|---|
| Molecular Weight | 641.20 g/mol |
| LogP | -0.3784 |
| Topological Polar Surface Area | 246.61 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 17 |
| Exact Mass | 641.2034 |
| Heavy Atoms | 43 |
| Complexity | 1464.6741 |
Chemical Identifiers
| CAS Number | 119206-61-0 |
|---|---|
| SMILES | CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)N[C@@H](C(CC(=O)O)CCl)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)O |
Product Overview
Dansylglutamyl-glycyl-arginyl chloromethyl ester (CAS 119206-61-0), with molecular formula C26H36ClN7O8S and molecular weight 641.20 g/mol. IUPAC: (4S)-5-[[2-[[(1S)-1-carboxy-4-(diaminomethylideneamino)butyl]amino]-2-oxoethyl]amino]-3-(chloromethyl)-4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-5-oxopentanoic acid.
Chemical Property Profile of Dansylglutamyl-glycyl-arginyl chloromethyl ester
Property Insights of Dansylglutamyl-glycyl-arginyl chloromethyl ester
The XLogP value of -0.3784 indicates that Dansylglutamyl-glycyl-arginyl chloromethyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 246.61 Ų indicates high polarity, suggesting Dansylglutamyl-glycyl-arginyl chloromethyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dansylglutamyl-glycyl-arginyl chloromethyl ester has 7 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dansylglutamyl-glycyl-arginyl chloromethyl ester?
The CAS number of Dansylglutamyl-glycyl-arginyl chloromethyl ester is 119206-61-0.
What is the molecular formula of Dansylglutamyl-glycyl-arginyl chloromethyl ester?
The molecular formula of Dansylglutamyl-glycyl-arginyl chloromethyl ester is C26H36ClN7O8S.
What is the molecular weight of Dansylglutamyl-glycyl-arginyl chloromethyl ester?
The molecular weight of Dansylglutamyl-glycyl-arginyl chloromethyl ester is 641.20 g/mol.
Where can I buy Dansylglutamyl-glycyl-arginyl chloromethyl ester?
You can request a quote for Dansylglutamyl-glycyl-arginyl chloromethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dansylglutamyl-glycyl-arginyl chloromethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Dansylglutamyl-glycyl-arginyl chloromethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.