Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy-
TL;DR: Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy- (CAS 70865-73-5) is a chemical compound with molecular formula C13H16ClN7O7 and molecular weight 417.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethyl)-3-[(2R,3R,4S,5R)-2-(2,6-dioxo-3H-purin-9-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]-1-nitrosourea
Also Known As: 2'-((((2-Chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxyxanthosine, Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy-, 1-(2-chloroethyl)-3-[(2R,3R,4S,5R)-2-(2,6-dioxo-3H-purin-9-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]-1-nitrosourea, 3-(2-chloroethyl)-1-[(2R,3R,4S,5R)-4-hydroxy-2-(2-hydroxy-6-oxo-6,9-dihydro-1H-purin-9-yl)-5-(hydroxymethyl)oxolan-3-yl]-3-nitrosourea, 3-(2-Chloroethyl)-1-[1-(1,6-dihydro-2-hydroxy-6-oxo-9H-purin-9-yl)-1,2-dideoxy-beta-D-ribofuranos-2-yl]-3-nitrosourea
| Molecular Formula | C13H16ClN7O7 |
|---|---|
| Molecular Weight | 417.08 g/mol |
| LogP | -2.0361 |
| Topological Polar Surface Area | 195.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.08 |
| Heavy Atoms | 28 |
| Complexity | 987.5063 |
Chemical Identifiers
| CAS Number | 70865-73-5 |
|---|---|
| SMILES | C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)NC(=O)N(CCCl)N=O)NC(=O)NC2=O |
Product Overview
Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy- (CAS 70865-73-5), with molecular formula C13H16ClN7O7 and molecular weight 417.08 g/mol. IUPAC: 1-(2-chloroethyl)-3-[(2R,3R,4S,5R)-2-(2,6-dioxo-3H-purin-9-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]-1-nitrosourea.
Chemical Property Profile of Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy-
Property Insights of Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy-
The XLogP value of -2.0361 indicates that Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 195.0 Ų indicates high polarity, suggesting Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy- has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy-?
The CAS number of Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy- is 70865-73-5.
What is the molecular formula of Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy-?
The molecular formula of Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy- is C13H16ClN7O7.
What is the molecular weight of Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy-?
The molecular weight of Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy- is 417.08 g/mol.
Where can I buy Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy-?
You can request a quote for Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy-?
Yes, KEHONG BIO provides custom synthesis services for Xanthosine, 2'-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-2'-deoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.