AC1MRQBC
3-chloro-N-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: Oprea1_192969|F0417-0936|3-chloro-N-[5-({[(2-fluorophenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide|3-chloro-N-(5-((2-((2-fluorophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide|3-chloro-N-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide|3-chloro-N-[5-[(2-fluorophenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide
| Molecular Formula | C17H12ClFN4O2S2 |
|---|---|
| Molecular Weight | 422.00742 g/mol |
| LogP | 4.3137 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 422.00742 |
| Monoisotopic Mass | 422.00742 |
| Heavy Atoms | 27 |
| Complexity | 982.8271 |
Chemical Identifiers
| CAS Number | 392298-48-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC(=CC=C3)Cl)F |
Product Overview
AC1MRQBC (CAS 392298-48-5), with molecular formula C17H12ClFN4O2S2 and molecular weight 422.00742 g/mol. IUPAC: 3-chloro-N-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide.
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