US9238653, Table 5, Compound 4
TL;DR: US9238653, Table 5, Compound 4 (CAS 900886-29-5) is a chemical compound with molecular formula C13H9ClF3N5 and molecular weight 327.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-5-methyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Also Known As: US9238653, Table 5, Compound 4, N-(4-chlorophenyl)-5-methyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine, VU0611737-1, (p-chlorophenyl)[6-methyl-2-(trifluoromethyl)-1,3,3a,7-tetraaza-4-indenyl]amine, N-(4-chlorophenyl)-5-methyl-2-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
| Molecular Formula | C13H9ClF3N5 |
|---|---|
| Molecular Weight | 327.05 g/mol |
| LogP | 3.84852 |
| Topological Polar Surface Area | 55.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.04987 |
| Heavy Atoms | 22 |
| Complexity | 826.0481 |
Chemical Identifiers
| CAS Number | 900886-29-5 |
|---|---|
| SMILES | CC1=NC2=NC(=NN2C(=C1)NC3=CC=C(C=C3)Cl)C(F)(F)F |
Product Overview
US9238653, Table 5, Compound 4 (CAS 900886-29-5), with molecular formula C13H9ClF3N5 and molecular weight 327.05 g/mol. IUPAC: N-(4-chlorophenyl)-5-methyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine.
Chemical Property Profile of US9238653, Table 5, Compound 4
Property Insights of US9238653, Table 5, Compound 4
The XLogP value of 3.84852 indicates that US9238653, Table 5, Compound 4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.11 Ų, US9238653, Table 5, Compound 4 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, US9238653, Table 5, Compound 4 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 US9238653, Table 5, Compound 4?
The CAS number of US9238653, Table 5, Compound 4 is 900886-29-5.
What is the molecular formula of US9238653, Table 5, Compound 4?
The molecular formula of US9238653, Table 5, Compound 4 is C13H9ClF3N5.
What is the molecular weight of US9238653, Table 5, Compound 4?
The molecular weight of US9238653, Table 5, Compound 4 is 327.05 g/mol.
Where can I buy US9238653, Table 5, Compound 4?
You can request a quote for US9238653, Table 5, Compound 4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for US9238653, Table 5, Compound 4?
Yes, KEHONG BIO provides custom synthesis services for US9238653, Table 5, Compound 4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.