MLS000102866
N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]butanamide
Also Known As: Oprea1_002184|AB00432304-05|SR-01000008925-1|F0748-0427|N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]butanamide|N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methyl-1,2,4-triazol-3-yl)thio]butanamide|N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]butanamide|N-(5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl)-2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)butanamide
| Molecular Formula | C15H15ClN6OS2 |
|---|---|
| Molecular Weight | 394.04373 g/mol |
| LogP | 3.4964 |
| Topological Polar Surface Area | 85.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 394.04373 |
| Monoisotopic Mass | 394.04373 |
| Heavy Atoms | 25 |
| Complexity | 880.2961 |
Chemical Identifiers
| CAS Number | 394237-09-3 |
|---|---|
| SMILES | CCC(C(=O)NC1=NN=C(S1)C2=CC=CC=C2Cl)SC3=NN=CN3C |
Product Overview
MLS000102866 (CAS 394237-09-3), with molecular formula C15H15ClN6OS2 and molecular weight 394.04373 g/mol. IUPAC: N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]butanamide.