AC1NMQD5
N-[5-[2-(4-bromoanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-(trifluoromethyl)benzamide
Also Known As: F0470-0162|N-(5-((2-((4-bromophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2-(trifluoromethyl)benzamide|N-[5-({[(4-bromophenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-2-(trifluoromethyl)benzamide|N-[5-[2-(4-bromoanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-(trifluoromethyl)benzamide|N-[5-[(4-bromophenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(trifluoromethyl)benzamide
| Molecular Formula | C18H12BrF3N4O2S2 |
|---|---|
| Molecular Weight | 515.95374 g/mol |
| LogP | 5.3025 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 515.95374 |
| Monoisotopic Mass | 515.95374 |
| Heavy Atoms | 30 |
| Complexity | 1058.0851 |
Chemical Identifiers
| CAS Number | 391869-41-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)Br)C(F)(F)F |
Product Overview
AC1NMQD5 (CAS 391869-41-3), with molecular formula C18H12BrF3N4O2S2 and molecular weight 515.95374 g/mol. IUPAC: N-[5-[2-(4-bromoanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-(trifluoromethyl)benzamide.
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