AC1M2JEQ
2-[[4-(4-chlorophenyl)-5-ethylsulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]pyrimidine
Also Known As: F1806-0080|2-(((4-(4-chlorophenyl)-5-(ethylthio)-4H-1,2,4-triazol-3-yl)methyl)thio)pyrimidine|2-({[4-(4-chlorophenyl)-5-(ethylsulfanyl)-4H-1,2,4-triazol-3-yl]methyl}sulfanyl)pyrimidine|2-[[4-(4-chlorophenyl)-5-ethylsulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]pyrimidine|4-(p-chlorophenyl)-3-(ethylthio)-5-[(2-pyrimidinylthio)methyl]-4H-1,2,4-triazole
| Molecular Formula | C15H14ClN5S2 |
|---|---|
| Molecular Weight | 363.0379 g/mol |
| LogP | 4.115 |
| Topological Polar Surface Area | 56.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 363.0379 |
| Monoisotopic Mass | 363.0379 |
| Heavy Atoms | 23 |
| Complexity | 761.2982 |
Chemical Identifiers
| CAS Number | 868221-75-4 |
|---|---|
| SMILES | CCSC1=NN=C(N1C2=CC=C(C=C2)Cl)CSC3=NC=CC=N3 |
Product Overview
AC1M2JEQ (CAS 868221-75-4), with molecular formula C15H14ClN5S2 and molecular weight 363.0379 g/mol. IUPAC: 2-[[4-(4-chlorophenyl)-5-ethylsulfanyl-1,2,4-triazol-3-yl]methylsulfanyl]pyrimidine.
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