1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane
TL;DR: 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane (CAS 83008-59-7) is a chemical compound with molecular formula C21H28N8O8 and molecular weight 520.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-[2-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-imino-2-oxopyrimidin-1-yl]ethyl]purin-6-one
Also Known As: 1-DC-DG-E, 1-(N(3)-Deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane, [1-(3-deoxycytidyl)-2-(1-deoxyguanosinyl)]ethane, 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-[2-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-imino-2-oxopyrimidin-1-yl]ethyl]purin-6-one, Guanosine, 2'-deoxy-1-(2-(3-(2-deoxy-beta-D-erythro-pentofuranosyl)-3,6-dihydro-6-imino-2-oxo-1(2H)-pyrimidinyl)ethyl)-
| Molecular Formula | C21H28N8O8 |
|---|---|
| Molecular Weight | 520.20 g/mol |
| LogP | -2.9 |
| Topological Polar Surface Area | 223.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 520.203 |
| Heavy Atoms | 37 |
| Complexity | 996.0 |
Chemical Identifiers
| CAS Number | 83008-59-7 |
|---|---|
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C=CC(=N)N(C2=O)CCN3C(=O)C4=C(N=C3N)N(C=N4)[C@H]5C[C@@H]([C@H](O5)CO)O)CO)O |
| InChIKey | IJKWEHCJBZGOAD-SWTKMSQOSA-N |
Product Overview
1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane (CAS 83008-59-7), with molecular formula C21H28N8O8 and molecular weight 520.20 g/mol. IUPAC: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-[2-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-imino-2-oxopyrimidin-1-yl]ethyl]purin-6-one.
Chemical Property Profile of 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane
Property Insights of 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane
The XLogP value of -2.9 indicates that 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 223.0 Ų indicates high polarity, suggesting 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane?
The CAS number of 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane is 83008-59-7.
What is the molecular formula of 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane?
The molecular formula of 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane is C21H28N8O8.
What is the molecular weight of 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane?
The molecular weight of 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane is 520.20 g/mol.
Where can I buy 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane?
You can request a quote for 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane?
Yes, KEHONG BIO provides custom synthesis services for 1-(N(3)-deoxycytidyl)-2-(N(1)-deoxyguanosinyl)ethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.