N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-3,6,7-trimethyl-N-[(5-methylfuran-2-yl)methyl]-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-3,6,7-trimethyl-N-[(5-methylfuran-2-yl)methyl]-1-benzofuran-2-carboxamide
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-3,6,7-trimethyl-N-[(5-methylfuran-2-yl)methyl]-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | D051-0215 |
| Compound Name: | N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-3,6,7-trimethyl-N-[(5-methylfuran-2-yl)methyl]-1-benzofuran-2-carboxamide |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C22 H25 N O5 S |
| Smiles: | Cc1ccc2c(C)c(C(N(Cc3ccc(C)o3)C3CCS(C3)(=O)=O)=O)oc2c1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8225 |
| logD: | 3.8225 |
| logSw: | -3.9298 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.881 |
| InChI Key: | HPRDFWAZSZZFHF-QGZVFWFLSA-N |