N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-[2-(4-methoxyphenoxy)acetamido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-[2-(4-methoxyphenoxy)acetamido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-[2-(4-methoxyphenoxy)acetamido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | Y070-4858 |
| Compound Name: | N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-[2-(4-methoxyphenoxy)acetamido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 492.61 |
| Molecular Formula: | C23 H28 N2 O6 S2 |
| Smiles: | CC1CCc2c(C(NC3CCS(C3)(=O)=O)=O)c(NC(COc3ccc(cc3)OC)=O)sc2C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.637 |
| logD: | 1.9024 |
| logSw: | -3.2208 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.45 |
| InChI Key: | GSPMGDOTLXDUEK-UHFFFAOYSA-N |