AC1MQC3O
N-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: N-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide|AF-399/41725464|N-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide|N-[5-[(2-chlorobenzyl)thio]-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide|N-[5-[(2-chlorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide
| Molecular Formula | C18H14ClN3O3S2 |
|---|---|
| Molecular Weight | 419.0165 g/mol |
| LogP | 4.2623 |
| Topological Polar Surface Area | 73.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 419.0165 |
| Monoisotopic Mass | 419.0165 |
| Heavy Atoms | 27 |
| Complexity | 966.2847 |
Chemical Identifiers
| CAS Number | 607697-85-8 |
|---|---|
| SMILES | C1C(OC2=CC=CC=C2O1)C(=O)NC3=NN=C(S3)SCC4=CC=CC=C4Cl |
Product Overview
AC1MQC3O (CAS 607697-85-8), with molecular formula C18H14ClN3O3S2 and molecular weight 419.0165 g/mol. IUPAC: N-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
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