AC1N2N52
4-butoxy-N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: F0417-0871|4-butoxy-N-(5-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide|4-butoxy-N-[5-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide|4-butoxy-N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide|4-butoxy-N-[5-[(4-fluorophenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide
| Molecular Formula | C21H21FN4O3S2 |
|---|---|
| Molecular Weight | 460.1039 g/mol |
| LogP | 4.8392 |
| Topological Polar Surface Area | 93.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 460.1039 |
| Monoisotopic Mass | 460.1039 |
| Heavy Atoms | 31 |
| Complexity | 1010.2241 |
Chemical Identifiers
| CAS Number | 392297-73-3 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)F |
Product Overview
AC1N2N52 (CAS 392297-73-3), with molecular formula C21H21FN4O3S2 and molecular weight 460.1039 g/mol. IUPAC: 4-butoxy-N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide.
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