1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)-
TL;DR: 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)- (CAS 160948-29-8) is a chemical compound with molecular formula C13H10F3N5O and molecular weight 309.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-phenylmethoxy-8-(trifluoromethyl)-7H-purin-2-amine
Also Known As: O6-Benzyl-8-(trifluoromethyl)guanine, 6-(BENZYLOXY)-8-(TRIFLUOROMETHYL)-1H-PURIN-2-AMINE, 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)-, 6-Benzyloxy-8-trifluoromethyl-9H-purin-2-amine, 2-Amino-8-(trifluoromethyl)-6-(benzyloxy)-9H-purine
| Molecular Formula | C13H10F3N5O |
|---|---|
| Molecular Weight | 309.08 g/mol |
| LogP | 2.5329 |
| Topological Polar Surface Area | 89.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.08374 |
| Heavy Atoms | 22 |
| Complexity | 800.53595 |
Chemical Identifiers
| CAS Number | 160948-29-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=NC(=NC3=C2NC(=N3)C(F)(F)F)N |
Product Overview
1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)- (CAS 160948-29-8), with molecular formula C13H10F3N5O and molecular weight 309.08 g/mol. IUPAC: 6-phenylmethoxy-8-(trifluoromethyl)-7H-purin-2-amine.
Chemical Property Profile of 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)-
Property Insights of 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)-
The XLogP value of 2.5329 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)-. The TPSA of 89.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)-. Following Lipinski's Rule of Five, 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)- 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 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)-?
The CAS number of 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)- is 160948-29-8.
What is the molecular formula of 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)-?
The molecular formula of 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)- is C13H10F3N5O.
What is the molecular weight of 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)-?
The molecular weight of 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)- is 309.08 g/mol.
Where can I buy 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)-?
You can request a quote for 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.