CID5206841
4-cyano-5-(1,3-dioxo-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindol-2-yl)-N,N,3-trimethylthiophene-2-carboxamide
Also Known As: AK-968/41024579|4-cyano-5-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-N,N,3-trimethylthiophene-2-carboxamide|[5-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0<2,6>]dec-4-yl)-4-cyano-3-methyl(2-t hienyl)]-N,N-dimethylcarboxamide|4-cyano-5-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-4-yl)-N,N,3-trimethyl-2-thiophenecarboxamide
| Molecular Formula | C17H17N3O4S |
|---|---|
| Molecular Weight | 359.09396 g/mol |
| LogP | 1.2968 |
| Topological Polar Surface Area | 90.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 359.09396 |
| Monoisotopic Mass | 359.09396 |
| Heavy Atoms | 25 |
| Complexity | 824.8098 |
Chemical Identifiers
| CAS Number | 6337-03-7 |
|---|---|
| SMILES | CC1=C(SC(=C1C#N)N2C(=O)C3C4CCC(C3C2=O)O4)C(=O)N(C)C |
Product Overview
CID5206841 (CAS 6337-03-7), with molecular formula C17H17N3O4S and molecular weight 359.09396 g/mol. IUPAC: 4-cyano-5-(1,3-dioxo-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindol-2-yl)-N,N,3-trimethylthiophene-2-carboxamide.
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