AC1MOOC2
2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-7-[1-(2,4-dichlorophenoxy)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidine
Also Known As: KS-000038T3|5D-008|2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-7-[1-(2,4-dichlorophenoxy)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidine|2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-7-[1-(2,4-dichlorophenoxy)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidine|2-[(2-chloro-6-fluorobenzyl)sulfanyl]-7-[1-(2,4-dichlorophenoxy)ethyl][1,2,4]triazolo[1,5-a]pyrimidine|2-[[(2-Chloro-6-fluorophenyl)methyl]thio]-7-[1-(2,4-dichlorophenoxy)ethyl][1,2,4]triazolo[1,5-a]pyrimidine
| Molecular Formula | C20H14Cl3FN4OS |
|---|---|
| Molecular Weight | 481.9938 g/mol |
| LogP | 6.6559 |
| Topological Polar Surface Area | 52.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 481.9938 |
| Monoisotopic Mass | 481.9938 |
| Heavy Atoms | 30 |
| Complexity | 1199.8538 |
Chemical Identifiers
| CAS Number | 338751-48-7 |
|---|---|
| SMILES | CC(C1=CC=NC2=NC(=NN12)SCC3=C(C=CC=C3Cl)F)OC4=C(C=C(C=C4)Cl)Cl |
Product Overview
AC1MOOC2 (CAS 338751-48-7), with molecular formula C20H14Cl3FN4OS and molecular weight 481.9938 g/mol. IUPAC: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-7-[1-(2,4-dichlorophenoxy)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidine.