Em 2487
TL;DR: Em 2487 (CAS 251561-62-3) is a chemical compound with molecular formula C32H57N5O16P2 and molecular weight 829.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-amino-2-oxoethyl)-[2-[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]-4,5-dihydroxy-3-(hydroxymethyl)cyclopent-2-en-1-yl]oxy-N-[hydroxy-[methyl(12-methyltridecyl)amino]oxyphosphoryl]phosphonamidic acid
Also Known As: Em 2487, N-(2-amino-2-oxoethyl)-[2-[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]-4,5-dihydroxy-3-(hydroxymethyl)cyclopent-2-en-1-yl]oxy-N-[hydroxy-[methyl(12-methyltridecyl)amino]oxyphosphoryl]phosphonamidic acid, N-(2-amino-2-oxo-ethyl)-[2-[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy]-4,5-dihydroxy-3-(hydroxymethyl)cyclopent-2-en-1-yl]oxy-N-[hydroxy-[methyl(12-methyltridecyl)amino]oxy-phosphoryl]phosphonamidic acid, N-(2-amino-2-oxoethyl)-(2-(((2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl)methoxy)-4,5-dihydroxy-3-(hydroxymethyl)cyclopent-2-en-1-yl)oxy-N-(hydroxy-(methyl(12-methyltridecyl)amino)oxyphosphoryl)phosphonamidic acid
| Molecular Formula | C32H57N5O16P2 |
|---|---|
| Molecular Weight | 829.33 g/mol |
| LogP | -3.1 |
| Topological Polar Surface Area | 312.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 25 |
| Exact Mass | 829.3276 |
| Heavy Atoms | 55 |
| Complexity | 1470.0 |
Chemical Identifiers
| CAS Number | 251561-62-3 |
|---|---|
| SMILES | CC(C)CCCCCCCCCCCN(C)OP(=O)(N(CC(=O)N)P(=O)(O)OC1C(C(C(=C1OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=CC(=O)NC3=O)O)O)CO)O)O)O |
| InChIKey | MTKDUTOCKQTOED-HKYCUWNMSA-N |
Product Overview
Em 2487 (CAS 251561-62-3), with molecular formula C32H57N5O16P2 and molecular weight 829.33 g/mol. IUPAC: N-(2-amino-2-oxoethyl)-[2-[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]-4,5-dihydroxy-3-(hydroxymethyl)cyclopent-2-en-1-yl]oxy-N-[hydroxy-[methyl(12-methyltridecyl)amino]oxyphosphoryl]phosphonamidic acid.
Chemical Property Profile of Em 2487
Property Insights of Em 2487
The XLogP value of -3.1 indicates that Em 2487 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 312.0 Ų indicates high polarity, suggesting Em 2487 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Em 2487 has 9 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Em 2487?
The CAS number of Em 2487 is 251561-62-3.
What is the molecular formula of Em 2487?
The molecular formula of Em 2487 is C32H57N5O16P2.
What is the molecular weight of Em 2487?
The molecular weight of Em 2487 is 829.33 g/mol.
Where can I buy Em 2487?
You can request a quote for Em 2487 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Em 2487?
Yes, KEHONG BIO provides custom synthesis services for Em 2487 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.