F3161-0158
TL;DR: F3161-0158 (CAS 725218-14-4) is a chemical compound with molecular formula C15H15ClN4O2S and molecular weight 350.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 7-(4-chlorophenyl)-5-methyl-2-methylsulfanyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Also Known As: F3161-0158, methyl 7-(4-chlorophenyl)-5-methyl-2-(methylsulfanyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate, METHYL 7-(4-CHLOROPHENYL)-5-METHYL-2-(METHYLSULFANYL)-4H,7H-[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE-6-CARBOXYLATE, methyl 7-(4-chlorophenyl)-5-methyl-2-methylsulfanyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate, methyl 7-(4-chlorophenyl)-5-methyl-2-(methylthio)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
| Molecular Formula | C15H15ClN4O2S |
|---|---|
| Molecular Weight | 350.06 g/mol |
| LogP | 3.1153 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.06042 |
| Heavy Atoms | 23 |
| Complexity | 785.2746 |
Chemical Identifiers
| CAS Number | 725218-14-4 |
|---|---|
| SMILES | CC1=C(C(N2C(=NC(=N2)SC)N1)C3=CC=C(C=C3)Cl)C(=O)OC |
Product Overview
F3161-0158 (CAS 725218-14-4), with molecular formula C15H15ClN4O2S and molecular weight 350.06 g/mol. IUPAC: methyl 7-(4-chlorophenyl)-5-methyl-2-methylsulfanyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate.
Chemical Property Profile of F3161-0158
Property Insights of F3161-0158
The XLogP value of 3.1153 indicates that F3161-0158 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for F3161-0158. Following Lipinski's Rule of Five, F3161-0158 has 1 hydrogen bond donor(s) and 6 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 F3161-0158?
The CAS number of F3161-0158 is 725218-14-4.
What is the molecular formula of F3161-0158?
The molecular formula of F3161-0158 is C15H15ClN4O2S.
What is the molecular weight of F3161-0158?
The molecular weight of F3161-0158 is 350.06 g/mol.
Where can I buy F3161-0158?
You can request a quote for F3161-0158 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3161-0158?
Yes, KEHONG BIO provides custom synthesis services for F3161-0158 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.