Tyrosyladenylate
TL;DR: Tyrosyladenylate (CAS 256643-13-7) is a chemical compound with molecular formula C19H23N7O8S and molecular weight 509.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl N-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]sulfamate
Also Known As: TYROSYLADENYLATE, Adenosine Impurity 68, 5'-O-(L-tyrosylsulfamoyl)adenosine, 5'-O-[N-(L-TYROSYL)SULFAMOYL]ADENOSINE, 5 -O-(L-Tyr-Aminosulfonyl)adenosine
| Molecular Formula | C19H23N7O8S |
|---|---|
| Molecular Weight | 509.13 g/mol |
| LogP | -2.1 |
| Topological Polar Surface Area | 246.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 8 |
| Exact Mass | 509.13287 |
| Heavy Atoms | 35 |
| Complexity | 840.0 |
Chemical Identifiers
| CAS Number | 256643-13-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C[C@@H](C(=O)NS(=O)(=O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O)O)N)O |
| InChIKey | MJZAZMKENKZBAJ-QTOWJTHWSA-N |
Product Overview
Tyrosyladenylate (CAS 256643-13-7), with molecular formula C19H23N7O8S and molecular weight 509.13 g/mol. IUPAC: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl N-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]sulfamate.
Chemical Property Profile of Tyrosyladenylate
Property Insights of Tyrosyladenylate
The XLogP value of -2.1 indicates that Tyrosyladenylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 246.0 Ų indicates high polarity, suggesting Tyrosyladenylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tyrosyladenylate has 6 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 Tyrosyladenylate?
The CAS number of Tyrosyladenylate is 256643-13-7.
What is the molecular formula of Tyrosyladenylate?
The molecular formula of Tyrosyladenylate is C19H23N7O8S.
What is the molecular weight of Tyrosyladenylate?
The molecular weight of Tyrosyladenylate is 509.13 g/mol.
Where can I buy Tyrosyladenylate?
You can request a quote for Tyrosyladenylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tyrosyladenylate?
Yes, KEHONG BIO provides custom synthesis services for Tyrosyladenylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.