AC1NKHI9
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-7-methyl-1-oxo-3,4-dihydroisochromene-3-carboxamide
Also Known As: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-7-methyl-1-oxo-3,4-dihydro-1H-isochromene-3-carboxamide|N-(5-ethyl-1,3,4-thiadiazol-2-yl)-7-methyl-1-oxoisochroman-3-carboxamide|N-(5-ethyl(1,3,4-thiadiazol-2-yl))(7-methyl-1-oxoisochroman-3-yl)carboxamide|N-(5-ethyl-1,3,4-thiadiazol-2-yl)-7-methyl-1-oxo-3,4-dihydroisochromene-3-carboxamide|N-(5-ETHYL-1,3,4-THIADIAZOL-2-YL)-7-METHYL-1-OXO-3,4-DIHYDRO-1H-2-BENZOPYRAN-3-CARBOXAMIDE|N-[(2E)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-7-methyl-1-oxo-3,4-dihydro-1H-isochromene-3-carboxamide
| Molecular Formula | C15H15N3O3S |
|---|---|
| Molecular Weight | 317.0834 g/mol |
| LogP | 2.12912 |
| Topological Polar Surface Area | 81.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 317.0834 |
| Monoisotopic Mass | 317.0834 |
| Heavy Atoms | 22 |
| Complexity | 741.384 |
Chemical Identifiers
| CAS Number | 853890-33-2 |
|---|---|
| SMILES | CCC1=NN=C(S1)NC(=O)C2CC3=C(C=C(C=C3)C)C(=O)O2 |
Product Overview
AC1NKHI9 (CAS 853890-33-2), with molecular formula C15H15N3O3S and molecular weight 317.0834 g/mol. IUPAC: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-7-methyl-1-oxo-3,4-dihydroisochromene-3-carboxamide.
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