![3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine structure](/static/products/606/606108-14-9.png)
3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine
TL;DR: 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine (CAS 606108-14-9) is a chemical compound with molecular formula C18H15FN6 and molecular weight 334.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine
Also Known As: ASN 06744969, 3H-1,2,3-Triazolo[4,5-d]pyrimidin-7-amine,N-[ methyl]-3- -, 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine, (3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)-(4-fluoro-benzyl)-amine, 3H-1,2,3-Triazolo[4,5-d]pyrimidin-7-amine, N-[(4-fluorophenyl)methyl]-3-(phenylmethyl)- (9CI)
| Molecular Formula | C18H15FN6 |
|---|---|
| Molecular Weight | 334.13 g/mol |
| LogP | 3.0208 |
| Topological Polar Surface Area | 68.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.13422 |
| Heavy Atoms | 25 |
| Complexity | 981.5625 |
Chemical Identifiers
| CAS Number | 606108-14-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C3=NC=NC(=C3N=N2)NCC4=CC=C(C=C4)F |
Product Overview
3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine (CAS 606108-14-9), with molecular formula C18H15FN6 and molecular weight 334.13 g/mol. IUPAC: 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine.
Chemical Property Profile of 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine
Property Insights of 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine
The XLogP value of 3.0208 indicates that 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine. Following Lipinski's Rule of Five, 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine has 1 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 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine?
The CAS number of 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine is 606108-14-9.
What is the molecular formula of 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine?
The molecular formula of 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine is C18H15FN6.
What is the molecular weight of 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine?
The molecular weight of 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine is 334.13 g/mol.
Where can I buy 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine?
You can request a quote for 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-benzyl-N-[(4-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.