Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol
TL;DR: Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol (CAS 6321-73-9) is a chemical compound with molecular formula C11H13ClN4O and molecular weight 252.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-(1R,2R)-2-(6-chloropurin-9-yl)cyclohexan-1-ol
Also Known As: KST-1A6834, Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol, (1r,2r)-2-(6-chloro-9h-purin-9-yl)cyclohexanol, (1R,2R)-2-(6-chloropurin-9-yl)cyclohexan-1-ol, Acetamino-phenethyl-malonsaeure-diethylester
| Molecular Formula | C11H13ClN4O |
|---|---|
| Molecular Weight | 252.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 63.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 252.07779 |
| Heavy Atoms | 17 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 6321-73-9 |
|---|---|
| SMILES | C1CC[C@H]([C@@H](C1)N2C=NC3=C2N=CN=C3Cl)O |
| InChIKey | CKTCXOLCNXSTKZ-HTQZYQBOSA-N |
Product Overview
Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol (CAS 6321-73-9), with molecular formula C11H13ClN4O and molecular weight 252.08 g/mol. IUPAC: trans-(1R,2R)-2-(6-chloropurin-9-yl)cyclohexan-1-ol.
Chemical Property Profile of Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol
Property Insights of Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol. The TPSA of 63.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol. Following Lipinski's Rule of Five, Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol has 1 hydrogen bond donor(s) and 4 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 Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol?
The CAS number of Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol is 6321-73-9.
What is the molecular formula of Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol?
The molecular formula of Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol is C11H13ClN4O.
What is the molecular weight of Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol?
The molecular weight of Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol is 252.08 g/mol.
Where can I buy Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol?
You can request a quote for Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol?
Yes, KEHONG BIO provides custom synthesis services for Trans-2-(6-chloro-9H-purin-9-yl)cyclohexanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.