N-{3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-3-methyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-{3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-3-methyl-1-benzofuran-2-carboxamide
N-{3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-3-methyl-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 5756-0839 |
| Compound Name: | N-{3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-3-methyl-1-benzofuran-2-carboxamide |
| Molecular Weight: | 472.58 |
| Molecular Formula: | C23 H24 N2 O5 S2 |
| Smiles: | Cc1c2ccccc2oc1C(Nc1c(C(NC2CCS(C2)(=O)=O)=O)c2CCCCc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4152 |
| logD: | 1.0277 |
| logSw: | -4.0845 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.146 |
| InChI Key: | WOPRXNJAAAHCNS-CQSZACIVSA-N |