O(6)-(2-chloroethyl)guanine
TL;DR: O(6)-(2-chloroethyl)guanine (CAS 100217-09-2) is a chemical compound with molecular formula C7H8ClN5O and molecular weight 213.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-chloroethoxy)-7H-purin-2-amine
Also Known As: O(6)-2-Ceg, o6-chloroethylguanine, O(6)-(2-Chloroethyl)guanine, 6-(2-chloroethoxy)-7H-purin-2-amine, 6-(2-Chloroethoxy)-1H-purine-2-amine
| Molecular Formula | C7H8ClN5O |
|---|---|
| Molecular Weight | 213.04 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 89.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.04173 |
| Heavy Atoms | 14 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 100217-09-2 |
|---|---|
| SMILES | C1=NC2=C(N1)C(=NC(=N2)N)OCCCl |
| InChIKey | VGKZFRLEZKOTCQ-UHFFFAOYSA-N |
Product Overview
O(6)-(2-chloroethyl)guanine (CAS 100217-09-2), with molecular formula C7H8ClN5O and molecular weight 213.04 g/mol. IUPAC: 6-(2-chloroethoxy)-7H-purin-2-amine.
Chemical Property Profile of O(6)-(2-chloroethyl)guanine
Property Insights of O(6)-(2-chloroethyl)guanine
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O(6)-(2-chloroethyl)guanine. The TPSA of 89.7 Ų falls within the moderate polarity range, balancing permeability and solubility for O(6)-(2-chloroethyl)guanine. Following Lipinski's Rule of Five, O(6)-(2-chloroethyl)guanine has 2 hydrogen bond donor(s) and 5 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 O(6)-(2-chloroethyl)guanine?
The CAS number of O(6)-(2-chloroethyl)guanine is 100217-09-2.
What is the molecular formula of O(6)-(2-chloroethyl)guanine?
The molecular formula of O(6)-(2-chloroethyl)guanine is C7H8ClN5O.
What is the molecular weight of O(6)-(2-chloroethyl)guanine?
The molecular weight of O(6)-(2-chloroethyl)guanine is 213.04 g/mol.
Where can I buy O(6)-(2-chloroethyl)guanine?
You can request a quote for O(6)-(2-chloroethyl)guanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O(6)-(2-chloroethyl)guanine?
Yes, KEHONG BIO provides custom synthesis services for O(6)-(2-chloroethyl)guanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.