AC1NQID3
3-fluoro-N-[5-[2-oxo-2-[[5-(2,3,5,6-tetramethylphenyl)-1,3,4-thiadiazol-2-yl]amino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: Oprea1_526050|F0509-1520|3-fluoro-N-(5-((2-oxo-2-((5-(2,3,5,6-tetramethylphenyl)-1,3,4-thiadiazol-2-yl)amino)ethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide|3-fluoro-N-[5-[2-oxo-2-[[5-(2,3,5,6-tetramethylphenyl)-1,3,4-thiadiazol-2-yl]amino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
| Molecular Formula | C23H21FN6O2S3 |
|---|---|
| Molecular Weight | 528.0872 g/mol |
| LogP | 5.41248 |
| Topological Polar Surface Area | 109.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 528.0872 |
| Monoisotopic Mass | 528.0872 |
| Heavy Atoms | 35 |
| Complexity | 1392.01 |
Chemical Identifiers
| CAS Number | 389072-63-3 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1C)C2=NN=C(S2)NC(=O)CSC3=NN=C(S3)NC(=O)C4=CC(=CC=C4)F)C)C |
Product Overview
AC1NQID3 (CAS 389072-63-3), with molecular formula C23H21FN6O2S3 and molecular weight 528.0872 g/mol. IUPAC: 3-fluoro-N-[5-[2-oxo-2-[[5-(2,3,5,6-tetramethylphenyl)-1,3,4-thiadiazol-2-yl]amino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide.
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