![1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]- structure](/static/products/168/168098-96-2.png)
1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]-
TL;DR: 1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]- (CAS 168098-96-2) 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-[[4-(trifluoromethyl)phenyl]methoxy]-7H-purin-2-amine
Also Known As: O6-(4-trifluoromethylbenzyl)guanine, O6-[4-(Trifluoromethyl)benzyl]guanine, 1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]-, 6-[[4-(trifluoromethyl)phenyl]methoxy]-7H-purin-2-amine, 6-[4-(Trifluoromethyl)benzyloxy]-1H-purin-2-amine
| 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 | 797.53595 |
Chemical Identifiers
| CAS Number | 168098-96-2 |
|---|---|
| SMILES | C1=CC(=CC=C1COC2=NC(=NC3=C2NC=N3)N)C(F)(F)F |
Product Overview
1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]- (CAS 168098-96-2), with molecular formula C13H10F3N5O and molecular weight 309.08 g/mol. IUPAC: 6-[[4-(trifluoromethyl)phenyl]methoxy]-7H-purin-2-amine.
Chemical Property Profile of 1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]-
Property Insights of 1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]-
The XLogP value of 2.5329 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]-. The TPSA of 89.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]-. Following Lipinski's Rule of Five, 1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]- 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-[[4-(trifluoromethyl)phenyl]methoxy]-?
The CAS number of 1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]- is 168098-96-2.
What is the molecular formula of 1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]-?
The molecular formula of 1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]- is C13H10F3N5O.
What is the molecular weight of 1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]-?
The molecular weight of 1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]- is 309.08 g/mol.
Where can I buy 1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]-?
You can request a quote for 1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]- 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-[[4-(trifluoromethyl)phenyl]methoxy]-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Purin-2-amine, 6-[[4-(trifluoromethyl)phenyl]methoxy]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.